N-ethyl-3,4-dimethoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: N-ethyl-3,4-dimethoxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-3,4-dimethoxy-benzenesulfonamide CAS Name: N-ethyl-3,4-dimethoxy-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-3,4-dimethoxybenzenesulfonamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-3,4-dimethoxy-benzenesulfonamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H28N2O4S/c1-4-23(18-12-13-22(16-18)15-17-8-6-5-7-9-17)28(24,25)19-10-11-20(26-2)21(14-19)27-3/h5-11,14,18H,4,12-13,15-16H2,1-3H3