1-[4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazino]ethanone Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C(C=C(N1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C26H29N3O4/c1-18-22(26(31)28-14-12-27(13-15-28)19(2)30)17-23(20-8-6-5-7-9-20)29(18)21-10-11-24(32-3)25(16-21)33-4/h5-11,16-17H,12-15H2,1-4H3