1-azanyl-4-(4-methylphenyl)sulfanyl-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name: 1-azanyl-4-(4-methylphenyl)sulfanyl-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid Openeye Name: 1-amino-9,10-dioxo-4-(p-tolylsulfanyl)anthracene-2-sulfonic acid CAS Name: 1-amino-4-[(4-methylphenyl)thio]-9,10-dioxo-2-anthracenesulfonic acid IUPAC Name: 1-amino-4-(4-methylphenyl)sulfanyl-9,10-dioxoanthracene-2-sulfonic acid Traditional Name: 1-amino-9,10-diketo-4-(p-tolylthio)anthracene-2-sulfonic acid Formula: C21H15NO5S2 MolecularWeight: 425.4775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O

InChI

InChI=1S/C21H15NO5S2/c1-11-6-8-12(9-7-11)28-15-10-16(29(25,26)27)19(22)18-17(15)20(23)13-4-2-3-5-14(13)21(18)24/h2-10H,22H2,1H3,(H,25,26,27)