1-benzofuran-2-yl-[4-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[4-[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(1-benzyl-2,5-dimethylpyrrole-3-carbonyl)piperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazino]methanone Formula: C27H27N3O3 MolecularWeight: 441.52158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H27N3O3/c1-19-16-23(20(2)30(19)18-21-8-4-3-5-9-21)26(31)28-12-14-29(15-13-28)27(32)25-17-22-10-6-7-11-24(22)33-25/h3-11,16-17H,12-15,18H2,1-2H3