1-(4-methylphenyl)-3-(pyridin-3-ylmethylamino)but-2-en-1-one

Systemtic Name: 1-(4-methylphenyl)-3-(pyridin-3-ylmethylamino)but-2-en-1-one Openeye Name: 1-(p-tolyl)-3-(3-pyridylmethylamino)but-2-en-1-one CAS Name: 1-(4-methylphenyl)-3-(3-pyridinylmethylamino)-2-buten-1-one IUPAC Name: 1-(4-methylphenyl)-3-(pyridin-3-ylmethylamino)but-2-en-1-one Traditional Name: 1-(p-tolyl)-3-(3-pyridylmethylamino)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)C(=O)C=C(C)NCC2=CN=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=C(C)NCC2=CN=CC=C2

InChI

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