Systematic / IUPAC Name: N-(2-{[2-(4-Chlorophenyl)ethyl]amino}-1,3-dioxo-2,3-dihydro-1H-inden-2-yl)-4-methylbenzamide
ID: Reference6816
Other Names: Benzamide, N-(2-{[2-(4-chlorophenyl)ethyl]amino}-2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-4-methyl-
Formula: C25H21ClN2O3
N1-{2-[(4-Chlorophenethyl)amino]-1,3-dioxo-2,3-dihydro-1H-inden-2-yl}-4-methylbenzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 119 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 9/13/2017 12:58:59 PM |
InChI | InChI=1S/C25H21ClN2O3/c1-16-6-10-18(11-7-16)24(31)28-25(27-15-14-17-8-12-19(26)13-9-17)22(29)20-4-2-3-5-21(20)23(25)30/h2-13,27H,14-15H2,1H3,(H,28,31) |
InChI Key | KFMWBZUVNMMCOP-UHFFFAOYSA-N |
Canonical SMILES | CC1=CC=C(C=C1)C(=O)NC2(C(=O)C3=CC=CC=C3C2=O)NCCC4=CC=C(C=C4)Cl |
CAS | |
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Other Names | Benzamide, N-(2-{[2-(4-chlorophenyl)ethyl]amino}-2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-4-methyl- |