4-azanyl-6-(2-hydroxyethylsulfonyl)naphthalene-1-sulfonic acid

Systemtic Name: 4-azanyl-6-(2-hydroxyethylsulfonyl)naphthalene-1-sulfonic acid Openeye Name: 4-amino-6-(2-hydroxyethylsulfonyl)naphthalene-1-sulfonic acid CAS Name: 4-amino-6-(2-hydroxyethylsulfonyl)-1-naphthalenesulfonic acid IUPAC Name: 4-amino-6-(2-hydroxyethylsulfonyl)naphthalene-1-sulfonic acid Traditional Name: 4-amino-6-(2-hydroxyethylsulfonyl)naphthalene-1-sulfonic acid Formula: C12H13NO6S2 MolecularWeight: 331.36472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2C=C1S(=O)(=O)CCO)N)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2C=C1S(=O)(=O)CCO)N)S(=O)(=O)O

InChI

InChI=1S/C12H13NO6S2/c13-11-3-4-12(21(17,18)19)9-2-1-8(7-10(9)11)20(15,16)6-5-14/h1-4,7,14H,5-6,13H2,(H,17,18,19)