Systematic / IUPAC Name: N'-[(4-Chlorobenzoyl)oxy]-3-(cyclopentyloxy)-4-methoxybenzenecarboximidamide
ID: Reference6772
Other Names: Benzenecarboximidamide, N'-[(4-chlorobenzoyl)oxy]-3-(cyclopentyloxy)-4-methoxy-
Formula: C20H21ClN2O4
N'-[(4-Chlorobenzoyl)oxy]-3-(cyclopentyloxy)-4-methoxybenzenecarboximidamide 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 | 8/28/2017 10:03:19 AM |
InChI | InChI=1S/C20H21ClN2O4/c1-25-17-11-8-14(12-18(17)26-16-4-2-3-5-16)19(22)23-27-20(24)13-6-9-15(21)10-7-13/h6-12,16H,2-5H2,1H3,(H2,22,23) |
InChI Key | KZMGCPISDHCDHC-UHFFFAOYSA-N |
Canonical SMILES | COC1=C(C=C(C=C1)C(=NOC(=O)C2=CC=C(C=C2)Cl)N)OC3CCCC3 |
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Other Names | Benzenecarboximidamide, N'-[(4-chlorobenzoyl)oxy]-3-(cyclopentyloxy)-4-methoxy- |
ChEMBL | CHEMBL1989549 |
ChemSpider | 2101229 |
PubChem | 9584546; 2823016; 5716110 |