7-azanyl-4-phenyl-2-sulfo-naphthalene-1-sulfonate

Systemtic Name: 7-azanyl-4-phenyl-2-sulfo-naphthalene-1-sulfonate Openeye Name: 7-amino-4-phenyl-2-sulfo-naphthalene-1-sulfonate CAS Name: 7-amino-4-phenyl-2-sulfo-1-naphthalenesulfonate IUPAC Name: 7-amino-4-phenyl-2-sulfonaphthalene-1-sulfonate Traditional Name: 7-amino-4-phenyl-2-sulfo-naphthalene-1-sulfonate Formula: C16H12NO6S2- MolecularWeight: 378.39958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO6S2/c17-11-6-7-12-13(10-4-2-1-3-5-10)9-15(24(18,19)20)16(14(12)8-11)25(21,22)23/h1-9H,17H2,(H,18,19,20)(H,21,22,23)/p-1