methyl 4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoate Openeye Name: methyl 4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoate CAS Name: 4-[[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoate Traditional Name: 4-[2-(2,5-dimethoxyphenyl)pyrrolidino]sulfonylbenzoic acid methyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H23NO6S/c1-25-15-8-11-19(26-2)17(13-15)18-5-4-12-21(18)28(23,24)16-9-6-14(7-10-16)20(22)27-3/h6-11,13,18H,4-5,12H2,1-3H3