ethyl 2-[(3-fluorophenyl)carbonylamino]-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-[(3-fluorophenyl)carbonylamino]-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-[(3-fluorobenzoyl)amino]-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-[[(3-fluorophenyl)-oxomethyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-fluorobenzoyl)amino]-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-[(3-fluorobenzoyl)amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H16FN3O3 MolecularWeight: 353.347043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H16FN3O3/c1-2-26-19(25)14-11-21-15-8-3-4-9-16(15)22-17(14)23-18(24)12-6-5-7-13(20)10-12/h3-11,22H,2H2,1H3,(H,23,24)