N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-4-methoxy-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-4-methoxy-3-methyl-benzenesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-4-methoxy-3-methyl-benzenesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-4-methoxy-3-methylbenzenesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-4-methoxy-3-methylbenzenesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-4-methoxy-3-methyl-benzenesulfonamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3)OC

InChI

InChI=1S/C22H31N3O3S/c1-17-15-20(11-12-22(17)28-4)29(26,27)23-16-21(25-13-5-6-14-25)18-7-9-19(10-8-18)24(2)3/h7-12,15,21,23H,5-6,13-14,16H2,1-4H3