1-azanyl-9,10-bis(oxidanylidene)-4-[(4-sulfocyclohexa-2,4-dien-1-yl)amino]anthracene-2-sulfonic acid

Systemtic Name: 1-azanyl-9,10-bis(oxidanylidene)-4-[(4-sulfocyclohexa-2,4-dien-1-yl)amino]anthracene-2-sulfonic acid Openeye Name: 1-amino-9,10-dioxo-4-[(4-sulfocyclohexa-2,4-dien-1-yl)amino]anthracene-2-sulfonic acid CAS Name: 1-amino-9,10-dioxo-4-[(4-sulfo-1-cyclohexa-2,4-dienyl)amino]-2-anthracenesulfonic acid IUPAC Name: 1-amino-9,10-dioxo-4-[(4-sulfocyclohexa-2,4-dien-1-yl)amino]anthracene-2-sulfonic acid Traditional Name: 1-amino-9,10-diketo-4-[(4-sulfocyclohexa-2,4-dien-1-yl)amino]anthracene-2-sulfonic acid Formula: C20H16N2O8S2 MolecularWeight: 476.47964

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1C=C(C=CC1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H16N2O8S2/c21-18-15(32(28,29)30)9-14(22-10-5-7-11(8-6-10)31(25,26)27)16-17(18)20(24)13-4-2-1-3-12(13)19(16)23/h1-5,7-10,22H,6,21H2,(H,25,26,27)(H,28,29,30)