[2-oxidanylidene-2-(3-phenylsulfanylpropanoylamino)ethyl] 4-[(2-chlorophenyl)methoxy]-3-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropanoylamino)ethyl] 4-[(2-chlorophenyl)methoxy]-3-methoxy-benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropanoylamino)ethyl] 4-[(2-chlorophenyl)methoxy]-3-methoxy-benzoate CAS Name: 4-[(2-chlorophenyl)methoxy]-3-methoxybenzoic acid [2-oxo-2-[[1-oxo-3-(phenylthio)propyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropanoylamino)ethyl] 4-[(2-chlorophenyl)methoxy]-3-methoxybenzoate Traditional Name: 4-(2-chlorobenzyl)oxy-3-methoxy-benzoic acid [2-keto-2-[3-(phenylthio)propanoylamino]ethyl] ester Formula: C26H24ClNO6S MolecularWeight: 513.98986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)CCSC2=CC=CC=C2)OCC3=CC=CC=C3Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)CCSC2=CC=CC=C2)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C26H24ClNO6S/c1-32-23-15-18(11-12-22(23)33-16-19-7-5-6-10-21(19)27)26(31)34-17-25(30)28-24(29)13-14-35-20-8-3-2-4-9-20/h2-12,15H,13-14,16-17H2,1H3,(H,28,29,30)