4-chloranyl-2-[2-(phenylmethyl)sulfinylethanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[2-(phenylmethyl)sulfinylethanoylamino]benzoic acid Openeye Name: 2-[(2-benzylsulfinylacetyl)amino]-4-chloro-benzoic acid CAS Name: 4-chloro-2-[[1-oxo-2-(phenylmethyl)sulfinylethyl]amino]benzoic acid IUPAC Name: 2-[(2-benzylsulfinylacetyl)amino]-4-chlorobenzoic acid Traditional Name: 2-[(2-benzylsulfinylacetyl)amino]-4-chloro-benzoic acid Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)CC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)CC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C16H14ClNO4S/c17-12-6-7-13(16(20)21)14(8-12)18-15(19)10-23(22)9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,18,19)(H,20,21)