3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: 3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: 3-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]thio]propanoate IUPAC Name: 3-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]thio]propionate Formula: C12H13ClNO4S- MolecularWeight: 302.75392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSCCC(=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSCCC(=O)[O-])Cl

InChI

InChI=1S/C12H14ClNO4S/c1-18-10-3-2-8(6-9(10)13)14-11(15)7-19-5-4-12(16)17/h2-3,6H,4-5,7H2,1H3,(H,14,15)(H,16,17)/p-1