4-[[9,10-bis(oxidanylidene)phenanthren-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[9,10-bis(oxidanylidene)phenanthren-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(9,10-dioxo-3-phenanthryl)amino]-4-oxo-butanoic acid CAS Name: 4-[(9,10-dioxo-3-phenanthrenyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(9,10-dioxophenanthren-3-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(9,10-diketo-3-phenanthryl)amino]-4-keto-butyric acid Formula: C18H13NO5 MolecularWeight: 323.29952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=CC(=C3)NC(=O)CCC(=O)O)C(=O)C2=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC(=C3)NC(=O)CCC(=O)O)C(=O)C2=O

InChI

InChI=1S/C18H13NO5/c20-15(7-8-16(21)22)19-10-5-6-13-14(9-10)11-3-1-2-4-12(11)17(23)18(13)24/h1-6,9H,7-8H2,(H,19,20)(H,21,22)