Fabesetron

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Systematic / IUPAC Name: (7R)-10-Methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydropyrido[1,2-a]indol-6(7H)-one

ID: Reference2896

Other Names: (+)-(7R)-8,9-Dihydro-10-methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]pyrido[1,2-a]indol-6(7H)-one;
Pyrido[1,2-a]indol-6(7H)-one,8,9-dihydro-10-methyl-7-[(4-methyl-1H-imidazol-5-yl)methyl]-, (7R)-

Formula: C18H19N3O

Spectral Data

Fabesetron mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 217
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/14/2015 7:13:48 AM
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Identificators

InChI InChI=1S/C18H19N3O/c1-11-14-5-3-4-6-17(14)21-16(11)8-7-13(18(21)22)9-15-12(2)19-10-20-15/h3-6,10,13H,7-9H2,1-2H3,(H,19,20)/t13-/m1/s1
InChI Key AEKQMJRJRAHOAP-CYBMUJFWSA-N
Canonical SMILES CC1=C2CCC(C(=O)N2C3=CC=CC=C13)CC4=C(NC=N4)C
CAS 129299907
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Other Names (+)-(7R)-8,9-Dihydro-10-methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]pyrido[1,2-a]indol-6(7H)-one;
Pyrido[1,2-a]indol-6(7H)-one,8,9-dihydro-10-methyl-7-[(4-methyl-1H-imidazol-5-yl)methyl]-, (7R)-

In Other Databases

PubChem 208947
ChemIDPlus 129300272
ChEMBL CHEMBL2104639
ChemSpider 181040