2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]benzoic acid

Systemtic Name: 2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]benzoic acid Openeye Name: 2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoic acid CAS Name: 2-methoxy-4-[(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepin-1-yl)-oxomethyl]benzoic acid IUPAC Name: 2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoic acid Traditional Name: 4-(4-keto-3-methyl-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)-2-methoxy-benzoic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C2=CC=CC=C2CC1=O)C(=O)C3=CC(=C(C=C3)C(=O)O)OC

Isomeric SMILES

CN1CN(C2=CC=CC=C2CC1=O)C(=O)C3=CC(=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C19H18N2O5/c1-20-11-21(15-6-4-3-5-12(15)10-17(20)22)18(23)13-7-8-14(19(24)25)16(9-13)26-2/h3-9H,10-11H2,1-2H3,(H,24,25)