5-(hydroxymethyl)-2-methyl-4-[[[2-(piperidin-1-ylmethyl)phenyl]methylamino]methylidene]pyridin-3-one

Systemtic Name: 5-(hydroxymethyl)-2-methyl-4-[[[2-(piperidin-1-ylmethyl)phenyl]methylamino]methylidene]pyridin-3-one Openeye Name: 5-(hydroxymethyl)-2-methyl-4-[[[2-(1-piperidylmethyl)phenyl]methylamino]methylene]pyridin-3-one CAS Name: 5-(hydroxymethyl)-2-methyl-4-[[[2-(1-piperidinylmethyl)phenyl]methylamino]methylidene]-3-pyridinone IUPAC Name: 5-(hydroxymethyl)-2-methyl-4-[[[2-(piperidin-1-ylmethyl)phenyl]methylamino]methylidene]pyridin-3-one Traditional Name: 2-methyl-5-methylol-4-[[[2-(piperidinomethyl)benzyl]amino]methylene]pyridin-3-one Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNCC2=CC=CC=C2CN3CCCCC3)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNCC2=CC=CC=C2CN3CCCCC3)C1=O)CO

InChI

InChI=1S/C21H27N3O2/c1-16-21(26)20(19(15-25)12-23-16)13-22-11-17-7-3-4-8-18(17)14-24-9-5-2-6-10-24/h3-4,7-8,12-13,22,25H,2,5-6,9-11,14-15H2,1H3