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

Systemtic Name: 1-[4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one Openeye Name: 1-[4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one CAS Name: 1-[4-[[1-(3-methoxyphenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 1-[4-[1-(3-methoxyphenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one Traditional Name: 1-[4-[1-(3-methoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazino]hexan-1-one Formula: C29H35N3O3 MolecularWeight: 473.6065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H35N3O3/c1-4-5-7-15-28(33)30-16-18-31(19-17-30)29(34)26-21-27(23-11-8-6-9-12-23)32(22(26)2)24-13-10-14-25(20-24)35-3/h6,8-14,20-21H,4-5,7,15-19H2,1-3H3