2-[[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]sulfamoyl]-5-methyl-benzenesulfonic acid

Systemtic Name: 2-[[4-azanyl-9,10-bis(oxidanylidene)anthracen-1-yl]sulfamoyl]-5-methyl-benzenesulfonic acid Openeye Name: 2-[(4-amino-9,10-dioxo-1-anthryl)sulfamoyl]-5-methyl-benzenesulfonic acid CAS Name: 2-[(4-amino-9,10-dioxo-1-anthracenyl)sulfamoyl]-5-methylbenzenesulfonic acid IUPAC Name: 2-[(4-amino-9,10-dioxoanthracen-1-yl)sulfamoyl]-5-methylbenzenesulfonic acid Traditional Name: 2-[(4-amino-9,10-diketo-1-anthryl)sulfamoyl]-5-methyl-besylic acid Formula: C21H16N2O7S2 MolecularWeight: 472.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

InChI

InChI=1S/C21H16N2O7S2/c1-11-6-9-16(17(10-11)32(28,29)30)31(26,27)23-15-8-7-14(22)18-19(15)21(25)13-5-3-2-4-12(13)20(18)24/h2-10,23H,22H2,1H3,(H,28,29,30)