2-azanyl-6-(2-sulfonatooxyethylsulfonyl)naphthalene-1-sulfonate

Systemtic Name: 2-azanyl-6-(2-sulfonatooxyethylsulfonyl)naphthalene-1-sulfonate Openeye Name: 2-amino-6-(2-sulfonatooxyethylsulfonyl)naphthalene-1-sulfonate CAS Name: 2-amino-6-(2-sulfonatooxyethylsulfonyl)-1-naphthalenesulfonate IUPAC Name: 2-amino-6-(2-sulfonatooxyethylsulfonyl)naphthalene-1-sulfonate Traditional Name: 2-amino-6-(2-sulfatoethylsulfonyl)naphthalene-1-sulfonate Formula: C12H11NO9S3-2 MolecularWeight: 409.41204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N)C=C1S(=O)(=O)CCOS(=O)(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N)C=C1S(=O)(=O)CCOS(=O)(=O)[O-]

InChI

InChI=1S/C12H13NO9S3/c13-11-4-1-8-7-9(2-3-10(8)12(11)24(16,17)18)23(14,15)6-5-22-25(19,20)21/h1-4,7H,5-6,13H2,(H,16,17,18)(H,19,20,21)/p-2