4-acetamido-6-chloranyl-5-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 4-acetamido-6-chloranyl-5-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 4-acetamido-6-chloro-5-hydroxy-naphthalene-1-sulfonic acid CAS Name: 4-acetamido-6-chloro-5-hydroxy-1-naphthalenesulfonic acid IUPAC Name: 4-acetamido-6-chloro-5-hydroxynaphthalene-1-sulfonic acid Traditional Name: 4-acetamido-6-chloro-5-hydroxy-naphthalene-1-sulfonic acid Formula: C12H10ClNO5S MolecularWeight: 315.7295

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC(=C2O)Cl

Isomeric SMILES

CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC(=C2O)Cl

InChI

InChI=1S/C12H10ClNO5S/c1-6(15)14-9-4-5-10(20(17,18)19)7-2-3-8(13)12(16)11(7)9/h2-5,16H,1H3,(H,14,15)(H,17,18,19)