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

Systemtic Name: 4-[[[4-[(2S)-butan-2-yl]phenyl]amino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one Openeye Name: 5-(hydroxymethyl)-2-methyl-4-[[4-[(1S)-1-methylpropyl]anilino]methylene]pyridin-3-one CAS Name: 4-[[4-[(2S)-butan-2-yl]anilino]methylidene]-5-(hydroxymethyl)-2-methyl-3-pyridinone IUPAC Name: 4-[[4-[(2S)-butan-2-yl]anilino]methylidene]-5-(hydroxymethyl)-2-methylpyridin-3-one Traditional Name: 2-methyl-5-methylol-4-[[4-[(1S)-1-methylpropyl]anilino]methylene]pyridin-3-one Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC=C2C(=CN=C(C2=O)C)CO

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC=C2C(=CN=C(C2=O)C)CO

InChI

InChI=1S/C18H22N2O2/c1-4-12(2)14-5-7-16(8-6-14)20-10-17-15(11-21)9-19-13(3)18(17)22/h5-10,12,20-21H,4,11H2,1-3H3/t12-/m0/s1