8-azanyl-1,5-bis(oxidanylidene)-4-[(4-sulfophenyl)amino]naphthalene-2-sulfonic acid

Systemtic Name: 8-azanyl-1,5-bis(oxidanylidene)-4-[(4-sulfophenyl)amino]naphthalene-2-sulfonic acid Openeye Name: 8-amino-1,5-dioxo-4-(4-sulfoanilino)naphthalene-2-sulfonic acid CAS Name: 8-amino-1,5-dioxo-4-(4-sulfoanilino)-2-naphthalenesulfonic acid IUPAC Name: 8-amino-1,5-dioxo-4-(4-sulfoanilino)naphthalene-2-sulfonic acid Traditional Name: 8-amino-1,5-diketo-4-(4-sulfoanilino)naphthalene-2-sulfonic acid Formula: C16H12N2O8S2 MolecularWeight: 424.40508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C3C(=O)C=CC(=C3C(=O)C(=C2)S(=O)(=O)O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC2=C3C(=O)C=CC(=C3C(=O)C(=C2)S(=O)(=O)O)N)S(=O)(=O)O

InChI

InChI=1S/C16H12N2O8S2/c17-10-5-6-12(19)15-11(7-13(28(24,25)26)16(20)14(10)15)18-8-1-3-9(4-2-8)27(21,22)23/h1-7,18H,17H2,(H,21,22,23)(H,24,25,26)