methyl 1-ethyl-4-phenyl-5-propanoyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylate

Systemtic Name: methyl 1-ethyl-4-phenyl-5-propanoyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylate Openeye Name: methyl 1-ethyl-4-phenyl-5-propanoyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylate CAS Name: 1-ethyl-5-(1-oxopropyl)-4-phenyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-phenyl-5-propanoyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylate Traditional Name: 1-ethyl-4-phenyl-5-propionyl-3,4-dihydro-2H-1,5-benzodiazepine-2-carboxylic acid methyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(N(C2=CC=CC=C21)CC)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1C(CC(N(C2=CC=CC=C21)CC)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-4-21(25)24-18-14-10-9-13-17(18)23(5-2)20(22(26)27-3)15-19(24)16-11-7-6-8-12-16/h6-14,19-20H,4-5,15H2,1-3H3