3-[(2-chloranyl-5-methyl-phenyl)amino]-1-pyridin-3-yl-but-3-en-1-one

Systemtic Name: 3-[(2-chloranyl-5-methyl-phenyl)amino]-1-pyridin-3-yl-but-3-en-1-one Openeye Name: 3-(2-chloro-5-methyl-anilino)-1-(3-pyridyl)but-3-en-1-one CAS Name: 3-(2-chloro-5-methylanilino)-1-(3-pyridinyl)-3-buten-1-one IUPAC Name: 3-(2-chloro-5-methylanilino)-1-pyridin-3-ylbut-3-en-1-one Traditional Name: 3-(2-chloro-5-methyl-anilino)-1-(3-pyridyl)but-3-en-1-one Formula: C16H15ClN2O MolecularWeight: 286.7561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O/c1-11-5-6-14(17)15(8-11)19-12(2)9-16(20)13-4-3-7-18-10-13/h3-8,10,19H,2,9H2,1H3