(E)-3-[(2,4-dimethylphenyl)amino]-1-pyridin-3-yl-but-2-en-1-one

Systemtic Name: (E)-3-[(2,4-dimethylphenyl)amino]-1-pyridin-3-yl-but-2-en-1-one Openeye Name: (E)-3-(2,4-dimethylanilino)-1-(3-pyridyl)but-2-en-1-one CAS Name: (E)-3-(2,4-dimethylanilino)-1-(3-pyridinyl)-2-buten-1-one IUPAC Name: (E)-3-(2,4-dimethylanilino)-1-pyridin-3-ylbut-2-en-1-one Traditional Name: (E)-3-(2,4-dimethylanilino)-1-(3-pyridyl)but-2-en-1-one Formula: C17H18N2O MolecularWeight: 266.33762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=CC(=O)C2=CN=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N/C(=C/C(=O)C2=CN=CC=C2)/C)C

InChI

InChI=1S/C17H18N2O/c1-12-6-7-16(13(2)9-12)19-14(3)10-17(20)15-5-4-8-18-11-15/h4-11,19H,1-3H3/b14-10+