1-[(4-azanyl-3-sulfo-phenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid

Systemtic Name: 1-[(4-azanyl-3-sulfo-phenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid Openeye Name: 1-(4-amino-3-sulfo-anilino)-9,10-dioxo-anthracene-2-sulfonic acid CAS Name: 1-(4-amino-3-sulfoanilino)-9,10-dioxo-2-anthracenesulfonic acid IUPAC Name: 1-(4-amino-3-sulfoanilino)-9,10-dioxoanthracene-2-sulfonic acid Traditional Name: 1-(4-amino-3-sulfo-anilino)-9,10-diketo-anthracene-2-sulfonic acid Formula: C20H14N2O8S2 MolecularWeight: 474.46376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)S(=O)(=O)O)NC4=CC(=C(C=C4)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)S(=O)(=O)O)NC4=CC(=C(C=C4)N)S(=O)(=O)O

InChI

InChI=1S/C20H14N2O8S2/c21-14-7-5-10(9-16(14)32(28,29)30)22-18-15(31(25,26)27)8-6-13-17(18)20(24)12-4-2-1-3-11(12)19(13)23/h1-9,22H,21H2,(H,25,26,27)(H,28,29,30)