tert-butyl 2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]benzoate

Systemtic Name: tert-butyl 2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]benzoate Openeye Name: tert-butyl 2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoate CAS Name: 2-methoxy-4-[(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepin-1-yl)-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoate Traditional Name: 4-(4-keto-3-methyl-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)-2-methoxy-benzoic acid tert-butyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=C(C=C1)C(=O)N2CN(C(=O)CC3=CC=CC=C32)C)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=C(C=C1)C(=O)N2CN(C(=O)CC3=CC=CC=C32)C)OC

InChI

InChI=1S/C23H26N2O5/c1-23(2,3)30-22(28)17-11-10-16(12-19(17)29-5)21(27)25-14-24(4)20(26)13-15-8-6-7-9-18(15)25/h6-12H,13-14H2,1-5H3