4-chloranyl-3-ethanoyl-2-[(4-methoxy-4-oxidanylidene-butyl)sulfanylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-ethanoyl-2-[(4-methoxy-4-oxidanylidene-butyl)sulfanylamino]benzoic acid Openeye Name: 3-acetyl-4-chloro-2-[(4-methoxy-4-oxo-butyl)sulfanylamino]benzoic acid CAS Name: 3-acetyl-4-chloro-2-[[(4-methoxy-4-oxobutyl)thio]amino]benzoic acid IUPAC Name: 3-acetyl-4-chloro-2-[(4-methoxy-4-oxobutyl)sulfanylamino]benzoic acid Traditional Name: 3-acetyl-4-chloro-2-[[(4-keto-4-methoxy-butyl)thio]amino]benzoic acid Formula: C14H16ClNO5S MolecularWeight: 345.79854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1NSCCCC(=O)OC)C(=O)O)Cl

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1NSCCCC(=O)OC)C(=O)O)Cl

InChI

InChI=1S/C14H16ClNO5S/c1-8(17)12-10(15)6-5-9(14(19)20)13(12)16-22-7-3-4-11(18)21-2/h5-6,16H,3-4,7H2,1-2H3,(H,19,20)