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

Systemtic Name: (4-hexylphenyl)-[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]methanone Openeye Name: (4-hexylphenyl)-[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]methanone CAS Name: (4-hexylphenyl)-[4-[[5-(3-methoxyphenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (4-hexylphenyl)-[4-[5-(3-methoxyphenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperazin-1-yl]methanone Traditional Name: (4-hexylphenyl)-[4-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazino]methanone Formula: C36H41N3O3 MolecularWeight: 563.72904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC(=CC=C4)OC)C5=CC=CC=C5)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC(=CC=C4)OC)C5=CC=CC=C5)C

InChI

InChI=1S/C36H41N3O3/c1-4-5-6-8-12-28-17-19-29(20-18-28)35(40)37-21-23-38(24-22-37)36(41)33-26-34(30-13-11-16-32(25-30)42-3)39(27(33)2)31-14-9-7-10-15-31/h7,9-11,13-20,25-26H,4-6,8,12,21-24H2,1-3H3