ethyl 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-benzamido-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H21N3O3/c1-3-15-18(21(26)27-4-2)19(23-17-13-9-8-12-16(17)22-15)24-20(25)14-10-6-5-7-11-14/h5-13,22H,3-4H2,1-2H3,(H,23,24,25)