1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1-pyridin-2-yl-pyrrol-3-yl)methyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1-pyridin-2-yl-pyrrol-3-yl)methyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[5-methyl-2-phenyl-1-(2-pyridyl)pyrrol-3-yl]methyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[5-methyl-2-phenyl-1-(2-pyridinyl)-3-pyrrolyl]methyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(5-methyl-2-phenyl-1-pyridin-2-ylpyrrol-3-yl)methyl]piperazine Traditional Name: 1-[[5-methyl-2-phenyl-1-(2-pyridyl)pyrrol-3-yl]methyl]-4-piperonyl-piperazine Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=N2)C3=CC=CC=C3)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=N2)C3=CC=CC=C3)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H30N4O2/c1-22-17-25(29(24-7-3-2-4-8-24)33(22)28-9-5-6-12-30-28)20-32-15-13-31(14-16-32)19-23-10-11-26-27(18-23)35-21-34-26/h2-12,17-18H,13-16,19-21H2,1H3