2-(4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)-3-oxidanylidene-prop-2-enoic acid

Systemtic Name: 2-(4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)-3-oxidanylidene-prop-2-enoic acid Openeye Name: 2-(4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)-3-oxo-prop-2-enoic acid CAS Name: 2-(4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)-3-oxo-2-propenoic acid IUPAC Name: 2-(4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)-3-oxoprop-2-enoic acid Traditional Name: 3-keto-2-(3-keto-4-methyl-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)acrylic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2NC(C1=O)C(=C=O)C(=O)O

Isomeric SMILES

CN1CC2=CC=CC=C2NC(C1=O)C(=C=O)C(=O)O

InChI

InChI=1S/C13H12N2O4/c1-15-6-8-4-2-3-5-10(8)14-11(12(15)17)9(7-16)13(18)19/h2-5,11,14H,6H2,1H3,(H,18,19)