ethyl 2-ethyl-4-(propanoylamino)-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-ethyl-4-(propanoylamino)-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-ethyl-4-(propanoylamino)-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-ethyl-4-(1-oxopropylamino)-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-(propanoylamino)-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-ethyl-4-propionamido-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O3/c1-4-11-15(17(22)23-6-3)16(20-14(21)5-2)19-13-10-8-7-9-12(13)18-11/h7-10,18H,4-6H2,1-3H3,(H,19,20,21)