N-methoxy-2-(4-methylphenyl)-2-[3-(phenylsulfonyl)piperazin-1-yl]ethanamine

Systemtic Name: N-methoxy-2-(4-methylphenyl)-2-[3-(phenylsulfonyl)piperazin-1-yl]ethanamine Openeye Name: 2-[3-(benzenesulfonyl)piperazin-1-yl]-N-methoxy-2-(p-tolyl)ethanamine CAS Name: 2-[3-(benzenesulfonyl)-1-piperazinyl]-N-methoxy-2-(4-methylphenyl)ethanamine IUPAC Name: 2-[3-(benzenesulfonyl)piperazin-1-yl]-N-methoxy-2-(4-methylphenyl)ethanamine Traditional Name: [2-(3-besylpiperazino)-2-(p-tolyl)ethyl]-methoxy-amine Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNOC)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(CNOC)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O3S/c1-16-8-10-17(11-9-16)19(14-22-26-2)23-13-12-21-20(15-23)27(24,25)18-6-4-3-5-7-18/h3-11,19-22H,12-15H2,1-2H3