4-[[[4-(azepan-1-yl)phenyl]amino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one

Systemtic Name: 4-[[[4-(azepan-1-yl)phenyl]amino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one Openeye Name: 4-[[4-(azepan-1-yl)anilino]methylene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one CAS Name: 4-[[4-(1-azepanyl)anilino]methylidene]-5-(hydroxymethyl)-2-methyl-3-pyridinone IUPAC Name: 4-[[4-(azepan-1-yl)anilino]methylidene]-5-(hydroxymethyl)-2-methylpyridin-3-one Traditional Name: 4-[[4-(azepan-1-yl)anilino]methylene]-2-methyl-5-methylol-pyridin-3-one Formula: C20H25N3O2 MolecularWeight: 339.4314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC2=CC=C(C=C2)N3CCCCCC3)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNC2=CC=C(C=C2)N3CCCCCC3)C1=O)CO

InChI

InChI=1S/C20H25N3O2/c1-15-20(25)19(16(14-24)12-21-15)13-22-17-6-8-18(9-7-17)23-10-4-2-3-5-11-23/h6-9,12-13,22,24H,2-5,10-11,14H2,1H3