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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18N2O5/c1-12-9-17(22)20-15-7-2-3-8-16(15)21(12)18(23)11-26-14-6-4-5-13(10-14)19(24)25/h2-8,10,12H,9,11H2,1H3,(H,20,22)(H,24,25)