(2,5-dimethoxyphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2,5-dimethoxyphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2,5-dimethoxybenzyl) ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23NO6S/c1-25-17-7-10-19(26-2)16(13-17)14-27-20(22)15-5-8-18(9-6-15)28(23,24)21-11-3-4-12-21/h5-10,13H,3-4,11-12,14H2,1-2H3