[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-[4-phenyl-1-(pyridin-3-ylmethyl)pyrrol-3-yl]methanone

Systemtic Name: [4-(3,5-dimethoxyphenyl)piperazin-1-yl]-[4-phenyl-1-(pyridin-3-ylmethyl)pyrrol-3-yl]methanone Openeye Name: [4-(3,5-dimethoxyphenyl)piperazin-1-yl]-[4-phenyl-1-(3-pyridylmethyl)pyrrol-3-yl]methanone CAS Name: [4-(3,5-dimethoxyphenyl)-1-piperazinyl]-[4-phenyl-1-(3-pyridinylmethyl)-3-pyrrolyl]methanone IUPAC Name: [4-(3,5-dimethoxyphenyl)piperazin-1-yl]-[4-phenyl-1-(pyridin-3-ylmethyl)pyrrol-3-yl]methanone Traditional Name: [4-(3,5-dimethoxyphenyl)piperazino]-[4-phenyl-1-(3-pyridylmethyl)pyrrol-3-yl]methanone Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(CC2)C(=O)C3=CN(C=C3C4=CC=CC=C4)CC5=CN=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(CC2)C(=O)C3=CN(C=C3C4=CC=CC=C4)CC5=CN=CC=C5)OC

InChI

InChI=1S/C29H30N4O3/c1-35-25-15-24(16-26(17-25)36-2)32-11-13-33(14-12-32)29(34)28-21-31(19-22-7-6-10-30-18-22)20-27(28)23-8-4-3-5-9-23/h3-10,15-18,20-21H,11-14,19H2,1-2H3