ethyl 4-[[4-(acetyloxymethyl)phenyl]carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 4-[[4-(acetyloxymethyl)phenyl]carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-[[4-(acetoxymethyl)benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-[[[4-(acetyloxymethyl)phenyl]-oxomethyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(acetyloxymethyl)benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-[[4-(acetoxymethyl)benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O5/c1-4-18-21(24(30)31-5-2)22(26-20-9-7-6-8-19(20)25-18)27-23(29)17-12-10-16(11-13-17)14-32-15(3)28/h6-13,25H,4-5,14H2,1-3H3,(H,26,27,29)