3-azanyl-4-chloranyl-5-[(4-methylphenyl)methylsulfinyl]benzoic acid

Systemtic Name: 3-azanyl-4-chloranyl-5-[(4-methylphenyl)methylsulfinyl]benzoic acid Openeye Name: 3-amino-4-chloro-5-(p-tolylmethylsulfinyl)benzoic acid CAS Name: 3-amino-4-chloro-5-[(4-methylphenyl)methylsulfinyl]benzoic acid IUPAC Name: 3-amino-4-chloro-5-[(4-methylphenyl)methylsulfinyl]benzoic acid Traditional Name: 3-amino-4-chloro-5-(4-methylbenzyl)sulfinyl-benzoic acid Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)C2=CC(=CC(=C2Cl)N)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)C2=CC(=CC(=C2Cl)N)C(=O)O

InChI

InChI=1S/C15H14ClNO3S/c1-9-2-4-10(5-3-9)8-21(20)13-7-11(15(18)19)6-12(17)14(13)16/h2-7H,8,17H2,1H3,(H,18,19)