1-[4-(phenylmethyl)piperidin-1-yl]-2-(4,6,7-trimethyl-1-benzofuran-3-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-(4,6,7-trimethyl-1-benzofuran-3-yl)ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(4,6,7-trimethylbenzofuran-3-yl)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-(4,6,7-trimethyl-3-benzofuranyl)ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(4,6,7-trimethyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(4,6,7-trimethylbenzofuran-3-yl)ethanone Formula: C25H29NO2 MolecularWeight: 375.50326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=CO2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C2=C1C(=CO2)CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C25H29NO2/c1-17-13-18(2)24-22(16-28-25(24)19(17)3)15-23(27)26-11-9-21(10-12-26)14-20-7-5-4-6-8-20/h4-8,13,16,21H,9-12,14-15H2,1-3H3