[2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid [2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid [2-keto-2-[3-(2-ketopyrrolidino)phenyl]ethyl] ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)OCC(=O)C2=CC(=CC=C2)N3CCCC3=O

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)OCC(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C21H21NO5S/c1-26-17-7-9-18(10-8-17)28-14-21(25)27-13-19(23)15-4-2-5-16(12-15)22-11-3-6-20(22)24/h2,4-5,7-10,12H,3,6,11,13-14H2,1H3