1-[3-(hydroxymethyl)piperidin-1-yl]-3-methyl-2-phenyl-pentan-1-one

Systemtic Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-3-methyl-2-phenyl-pentan-1-one Openeye Name: 1-[3-(hydroxymethyl)-1-piperidyl]-3-methyl-2-phenyl-pentan-1-one CAS Name: 1-[3-(hydroxymethyl)-1-piperidinyl]-3-methyl-2-phenyl-1-pentanone IUPAC Name: 1-[3-(hydroxymethyl)piperidin-1-yl]-3-methyl-2-phenylpentan-1-one Traditional Name: 3-methyl-1-(3-methylolpiperidino)-2-phenyl-pentan-1-one Formula: C18H27NO2 MolecularWeight: 289.41248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)N2CCCC(C2)CO

Isomeric SMILES

CCC(C)C(C1=CC=CC=C1)C(=O)N2CCCC(C2)CO

InChI

InChI=1S/C18H27NO2/c1-3-14(2)17(16-9-5-4-6-10-16)18(21)19-11-7-8-15(12-19)13-20/h4-6,9-10,14-15,17,20H,3,7-8,11-13H2,1-2H3