5-methyl-2-[[4-oxidanyl-2,3-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonic acid

Systemtic Name: 5-methyl-2-[[4-oxidanyl-2,3-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonic acid Openeye Name: 2-[(4-hydroxy-2,3-dioxo-1-anthryl)amino]-5-methyl-benzenesulfonic acid CAS Name: 2-[(4-hydroxy-2,3-dioxo-1-anthracenyl)amino]-5-methylbenzenesulfonic acid IUPAC Name: 2-[(4-hydroxy-2,3-dioxoanthracen-1-yl)amino]-5-methylbenzenesulfonic acid Traditional Name: 2-[(4-hydroxy-2,3-diketo-1-anthryl)amino]-5-methyl-besylic acid Formula: C21H15NO6S MolecularWeight: 409.4119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C3C=C4C=CC=CC4=CC3=C(C(=O)C2=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C3C=C4C=CC=CC4=CC3=C(C(=O)C2=O)O)S(=O)(=O)O

InChI

InChI=1S/C21H15NO6S/c1-11-6-7-16(17(8-11)29(26,27)28)22-18-14-9-12-4-2-3-5-13(12)10-15(14)19(23)21(25)20(18)24/h2-10,22-23H,1H3,(H,26,27,28)