[4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-(4-pentylphenyl)methanone

Systemtic Name: [4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-(4-pentylphenyl)methanone Openeye Name: [4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]-(4-pentylphenyl)methanone CAS Name: [4-[[1-(3-methoxyphenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-(4-pentylphenyl)methanone IUPAC Name: [4-[1-(3-methoxyphenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazin-1-yl]-(4-pentylphenyl)methanone Traditional Name: (4-amylphenyl)-[4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazino]methanone Formula: C35H39N3O3 MolecularWeight: 549.70246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC(=CC=C5)OC)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC(=CC=C5)OC)C

InChI

InChI=1S/C35H39N3O3/c1-4-5-7-11-27-16-18-29(19-17-27)34(39)36-20-22-37(23-21-36)35(40)32-25-33(28-12-8-6-9-13-28)38(26(32)2)30-14-10-15-31(24-30)41-3/h6,8-10,12-19,24-25H,4-5,7,11,20-23H2,1-3H3