7-acetamido-3-methyl-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-acetamido-3-methyl-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-acetamido-4-hydroxy-3-methyl-naphthalene-2-sulfonic acid CAS Name: 7-acetamido-4-hydroxy-3-methyl-2-naphthalenesulfonic acid IUPAC Name: 7-acetamido-4-hydroxy-3-methylnaphthalene-2-sulfonic acid Traditional Name: 7-acetamido-4-hydroxy-3-methyl-naphthalene-2-sulfonic acid Formula: C13H13NO5S MolecularWeight: 295.31102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=C1O)NC(=O)C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=C1O)NC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C13H13NO5S/c1-7-12(20(17,18)19)6-9-5-10(14-8(2)15)3-4-11(9)13(7)16/h3-6,16H,1-2H3,(H,14,15)(H,17,18,19)