4-[[9,10-bis(oxidanylidene)-4-phenylsulfanyl-anthracen-1-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[9,10-bis(oxidanylidene)-4-phenylsulfanyl-anthracen-1-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(9,10-dioxo-4-phenylsulfanyl-1-anthryl)amino]-4-oxo-butanoic acid CAS Name: 4-[[9,10-dioxo-4-(phenylthio)-1-anthracenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(9,10-dioxo-4-phenylsulfanylanthracen-1-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[[9,10-diketo-4-(phenylthio)-1-anthryl]amino]-4-keto-butyric acid Formula: C24H17NO5S MolecularWeight: 431.46048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C3C(=C(C=C2)NC(=O)CCC(=O)O)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)SC2=C3C(=C(C=C2)NC(=O)CCC(=O)O)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H17NO5S/c26-19(12-13-20(27)28)25-17-10-11-18(31-14-6-2-1-3-7-14)22-21(17)23(29)15-8-4-5-9-16(15)24(22)30/h1-11H,12-13H2,(H,25,26)(H,27,28)