3-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propanoic acid

Systemtic Name: 3-[[4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propanoic acid Openeye Name: 3-[(4-hydroxy-9,10-dioxo-1-anthryl)amino]propanoic acid CAS Name: 3-[(4-hydroxy-9,10-dioxo-1-anthracenyl)amino]propanoic acid IUPAC Name: 3-[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]propanoic acid Traditional Name: 3-[(4-hydroxy-9,10-diketo-1-anthryl)amino]propionic acid Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NCCC(=O)O

InChI

InChI=1S/C17H13NO5/c19-12-6-5-11(18-8-7-13(20)21)14-15(12)17(23)10-4-2-1-3-9(10)16(14)22/h1-6,18-19H,7-8H2,(H,20,21)