(7-methyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) cyclohexanecarboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) cyclohexanecarboxylate Openeye Name: (7-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid (7-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) ester IUPAC Name: (7-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid (2-keto-7-methyl-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(N=C2C3=CC=CC=C3)OC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(N=C2C3=CC=CC=C3)OC(=O)C4CCCCC4

InChI

InChI=1S/C23H24N2O3/c1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)25-22(21(26)24-19)28-23(27)17-10-6-3-7-11-17/h2,4-5,8-9,12-14,17,22H,3,6-7,10-11H2,1H3,(H,24,26)