(E)-3-[(4-methylphenyl)methylamino]-1-pyridin-3-yl-but-2-en-1-one

Systemtic Name: (E)-3-[(4-methylphenyl)methylamino]-1-pyridin-3-yl-but-2-en-1-one Openeye Name: (E)-3-(p-tolylmethylamino)-1-(3-pyridyl)but-2-en-1-one CAS Name: (E)-3-[(4-methylphenyl)methylamino]-1-(3-pyridinyl)-2-buten-1-one IUPAC Name: (E)-3-[(4-methylphenyl)methylamino]-1-pyridin-3-ylbut-2-en-1-one Traditional Name: (E)-3-[(4-methylbenzyl)amino]-1-(3-pyridyl)but-2-en-1-one Formula: C17H18N2O MolecularWeight: 266.33762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O/c1-13-5-7-15(8-6-13)11-19-14(2)10-17(20)16-4-3-9-18-12-16/h3-10,12,19H,11H2,1-2H3/b14-10+