3,4-dimethoxy-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-3,4-dimethoxy-benzenesulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H31N3O4S/c1-28-21-10-9-20(17-22(21)29-2)30(26,27)23-11-6-12-24-13-15-25(16-14-24)18-19-7-4-3-5-8-19/h3-5,7-10,17,23H,6,11-16,18H2,1-2H3