[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C17H16ClNO4S MolecularWeight: 365.83124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)Cl)N

InChI

InChI=1S/C17H16ClNO4S/c1-22-16-8-14(19)13(18)7-12(16)17(21)23-9-15(20)10-3-5-11(24-2)6-4-10/h3-8H,9,19H2,1-2H3