4-oxidanylidene-4-(6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanoic acid

Systemtic Name: 4-oxidanylidene-4-(6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanoic acid Openeye Name: 4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanoic acid CAS Name: 4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanoic acid IUPAC Name: 4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanoic acid Traditional Name: 4-keto-4-(6-keto-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butyric acid Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)CCC(=O)O)N=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)CCC(=O)O)N=CC=C3

InChI

InChI=1S/C16H13N3O4/c20-13(7-8-14(21)22)19-12-6-2-1-4-10(12)16(23)18-11-5-3-9-17-15(11)19/h1-6,9H,7-8H2,(H,18,23)(H,21,22)