1-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]ethenyl]-4-(phenylmethyl)piperidine

Systemtic Name: 1-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]ethenyl]-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-[1-[1-(p-tolylsulfonyl)pyrrol-3-yl]vinyl]piperidine CAS Name: 1-[1-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]ethenyl]-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-[1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]ethenyl]piperidine Traditional Name: 4-benzyl-1-[1-(1-tosylpyrrol-3-yl)vinyl]piperidine Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=C)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=C)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2S/c1-20-8-10-25(11-9-20)30(28,29)27-17-14-24(19-27)21(2)26-15-12-23(13-16-26)18-22-6-4-3-5-7-22/h3-11,14,17,19,23H,2,12-13,15-16,18H2,1H3