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

Systemtic Name: [2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-(3-chloro-4-methoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methoxyanilino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl] ester Formula: C18H17ClFNO4S MolecularWeight: 397.848283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C18H17ClFNO4S/c1-24-16-7-4-13(10-15(16)19)21-17(22)11-25-18(23)8-9-26-14-5-2-12(20)3-6-14/h2-7,10H,8-9,11H2,1H3,(H,21,22)