ethyl 3-[2,5-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl]sulfanylpropanoate

Systemtic Name: ethyl 3-[2,5-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl]sulfanylpropanoate Openeye Name: ethyl 3-[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl]sulfanylpropanoate CAS Name: 3-[[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]-3-pyrrolidinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl]sulfanylpropanoate Traditional Name: 3-[[2,5-diketo-1-(4-phenoxybenzyl)pyrrolidin-3-yl]thio]propionic acid ethyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1CC(=O)N(C1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCSC1CC(=O)N(C1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H23NO5S/c1-2-27-21(25)12-13-29-19-14-20(24)23(22(19)26)15-16-8-10-18(11-9-16)28-17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3