1-[4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]dodecan-1-one

Systemtic Name: 1-[4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]dodecan-1-one Openeye Name: 1-[4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]dodecan-1-one CAS Name: 1-[4-[[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-dodecanone IUPAC Name: 1-[4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]dodecan-1-one Traditional Name: 1-[4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazino]dodecan-1-one Formula: C35H46ClN3O3 MolecularWeight: 592.21104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)OC)C4=CC=CC=C4Cl)C

Isomeric SMILES

CCCCCCCCCCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)OC)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C35H46ClN3O3/c1-4-5-6-7-8-9-10-11-12-17-34(40)37-22-24-38(25-23-37)35(41)30-26-33(28-18-20-29(42-3)21-19-28)39(27(30)2)32-16-14-13-15-31(32)36/h13-16,18-21,26H,4-12,17,22-25H2,1-3H3