2-azanyl-4-chloranyl-5-methyl-benzenesulfonic acid; 3-oxidanylnaphthalene-2-carboxylic acid

Systemtic Name: 2-azanyl-4-chloranyl-5-methyl-benzenesulfonic acid; 3-oxidanylnaphthalene-2-carboxylic acid Openeye Name: 2-amino-4-chloro-5-methyl-benzenesulfonic acid; 3-hydroxynaphthalene-2-carboxylic acid CAS Name: 2-amino-4-chloro-5-methylbenzenesulfonic acid; 3-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: 2-amino-4-chloro-5-methylbenzenesulfonic acid; 3-hydroxynaphthalene-2-carboxylic acid Traditional Name: 2-amino-4-chloro-5-methyl-besylic acid; 3-hydroxy-2-naphthoic acid Formula: C18H16ClNO6S MolecularWeight: 409.84074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)N)S(=O)(=O)O.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)N)S(=O)(=O)O.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O

InChI

InChI=1S/C11H8O3.C7H8ClNO3S/c12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14;1-4-2-7(13(10,11)12)6(9)3-5(4)8/h1-6,12H,(H,13,14);2-3H,9H2,1H3,(H,10,11,12)