1-[[4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methyl]-4-phenyl-piperazine

Systemtic Name: 1-[[4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methyl]-4-phenyl-piperazine Openeye Name: 1-[[1-(benzenesulfonyl)-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-4-phenyl-piperazine CAS Name: 1-[[1-(benzenesulfonyl)-4-(3-methoxyphenyl)-3-pyrrolidinyl]methyl]-4-phenylpiperazine IUPAC Name: 1-[[1-(benzenesulfonyl)-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-4-phenylpiperazine Traditional Name: 1-[[1-besyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-4-phenyl-piperazine Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CN(CC2CN3CCN(CC3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2CN(CC2CN3CCN(CC3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H33N3O3S/c1-34-26-12-8-9-23(19-26)28-22-31(35(32,33)27-13-6-3-7-14-27)21-24(28)20-29-15-17-30(18-16-29)25-10-4-2-5-11-25/h2-14,19,24,28H,15-18,20-22H2,1H3