methyl 4-[1-(4-butylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoate

Systemtic Name: methyl 4-[1-(4-butylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoate Openeye Name: methyl 4-[1-(4-butylsulfonyloxyphenyl)-5-oxo-pyrrolidin-3-yl]-2-methoxy-benzoate CAS Name: 4-[1-(4-butylsulfonyloxyphenyl)-5-oxo-3-pyrrolidinyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-butylsulfonyloxyphenyl)-5-oxopyrrolidin-3-yl]-2-methoxybenzoate Traditional Name: 4-[1-(4-butylsulfonyloxyphenyl)-5-keto-pyrrolidin-3-yl]-2-methoxy-benzoic acid methyl ester Formula: C23H27NO7S MolecularWeight: 461.52798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)OC1=CC=C(C=C1)N2CC(CC2=O)C3=CC(=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CCCCS(=O)(=O)OC1=CC=C(C=C1)N2CC(CC2=O)C3=CC(=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C23H27NO7S/c1-4-5-12-32(27,28)31-19-9-7-18(8-10-19)24-15-17(14-22(24)25)16-6-11-20(23(26)30-3)21(13-16)29-2/h6-11,13,17H,4-5,12,14-15H2,1-3H3