1-[(4-methylphenyl)sulfonylamino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name: 1-[(4-methylphenyl)sulfonylamino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid Openeye Name: 9,10-dioxo-1-(p-tolylsulfonylamino)anthracene-2-sulfonic acid CAS Name: 1-[(4-methylphenyl)sulfonylamino]-9,10-dioxo-2-anthracenesulfonic acid IUPAC Name: 1-[(4-methylphenyl)sulfonylamino]-9,10-dioxoanthracene-2-sulfonic acid Traditional Name: 9,10-diketo-1-(tosylamino)anthracene-2-sulfonic acid Formula: C21H15NO7S2 MolecularWeight: 457.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O

InChI

InChI=1S/C21H15NO7S2/c1-12-6-8-13(9-7-12)30(25,26)22-19-17(31(27,28)29)11-10-16-18(19)21(24)15-5-3-2-4-14(15)20(16)23/h2-11,22H,1H3,(H,27,28,29)