1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Openeye Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone CAS Name: 1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Traditional Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(2-phenoxyethyl)piperazino]ethanone Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2/c1-22-19-26(23(2)30(22)20-24-9-5-3-6-10-24)27(31)21-29-15-13-28(14-16-29)17-18-32-25-11-7-4-8-12-25/h3-12,19H,13-18,20-21H2,1-2H3