2-[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]-1-(phenylmethyl)piperidine

Systemtic Name: 2-[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]-1-(phenylmethyl)piperidine Openeye Name: 1-benzyl-2-[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]piperidine CAS Name: 2-[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]-1-(phenylmethyl)piperidine IUPAC Name: 1-benzyl-2-[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]piperidine Traditional Name: 1-benzyl-2-[5-(5-esyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]piperidine Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)C3CCCCN3CC4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC)C2=CC=C(N2)C3CCCCN3CC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O3S/c1-3-31(28,29)20-12-15-25(30-2)21(17-20)22-13-14-23(26-22)24-11-7-8-16-27(24)18-19-9-5-4-6-10-19/h4-6,9-10,12-15,17,24,26H,3,7-8,11,16,18H2,1-2H3