1-azanyl-4-[(3-chloranylsulfonylphenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate

Systemtic Name: 1-azanyl-4-[(3-chloranylsulfonylphenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate Openeye Name: 1-amino-4-(3-chlorosulfonylanilino)-9,10-dioxo-anthracene-2-sulfonate CAS Name: 1-amino-4-(3-chlorosulfonylanilino)-9,10-dioxo-2-anthracenesulfonate IUPAC Name: 1-amino-4-(3-chlorosulfonylanilino)-9,10-dioxoanthracene-2-sulfonate Traditional Name: 1-amino-4-(3-chlorosulfonylanilino)-9,10-diketo-anthracene-2-sulfonate Formula: C20H12ClN2O7S2- MolecularWeight: 491.90148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)Cl)S(=O)(=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)Cl)S(=O)(=O)[O-])N

InChI

InChI=1S/C20H13ClN2O7S2/c21-31(26,27)11-5-3-4-10(8-11)23-14-9-15(32(28,29)30)18(22)17-16(14)19(24)12-6-1-2-7-13(12)20(17)25/h1-9,23H,22H2,(H,28,29,30)/p-1