1-[1-[5-(5-bromanyl-2,3-dimethoxy-phenyl)-1H-pyrrol-2-yl]-2-phenyl-ethyl]piperidine

Systemtic Name: 1-[1-[5-(5-bromanyl-2,3-dimethoxy-phenyl)-1H-pyrrol-2-yl]-2-phenyl-ethyl]piperidine Openeye Name: 1-[1-[5-(5-bromo-2,3-dimethoxy-phenyl)-1H-pyrrol-2-yl]-2-phenyl-ethyl]piperidine CAS Name: 1-[1-[5-(5-bromo-2,3-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-phenylethyl]piperidine IUPAC Name: 1-[1-[5-(5-bromo-2,3-dimethoxyphenyl)-1H-pyrrol-2-yl]-2-phenylethyl]piperidine Traditional Name: 1-[1-[5-(5-bromo-2,3-dimethoxy-phenyl)-1H-pyrrol-2-yl]-2-phenyl-ethyl]piperidine Formula: C25H29BrN2O2 MolecularWeight: 469.41396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C2=CC=C(N2)C(CC3=CC=CC=C3)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C2=CC=C(N2)C(CC3=CC=CC=C3)N4CCCCC4)OC

InChI

InChI=1S/C25H29BrN2O2/c1-29-24-17-19(26)16-20(25(24)30-2)21-11-12-22(27-21)23(28-13-7-4-8-14-28)15-18-9-5-3-6-10-18/h3,5-6,9-12,16-17,23,27H,4,7-8,13-15H2,1-2H3