3,6-bis(chloranyl)-4-(3-methylphenyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one

Systemtic Name: 3,6-bis(chloranyl)-4-(3-methylphenyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one Openeye Name: 3,6-dichloro-4-(m-tolyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one CAS Name: 3,6-dichloro-4-(3-methylphenyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one IUPAC Name: 3,6-dichloro-4-(3-methylphenyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one Traditional Name: 3,6-dichloro-4-(m-tolyl)-2-pent-1-ynyl-3,4-dihydropyridazin-5-one Formula: C16H16Cl2N2O MolecularWeight: 323.21704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CN1C(C(C(=O)C(=N1)Cl)C2=CC(=CC=C2)C)Cl

Isomeric SMILES

CCCC#CN1C(C(C(=O)C(=N1)Cl)C2=CC(=CC=C2)C)Cl

InChI

InChI=1S/C16H16Cl2N2O/c1-3-4-5-9-20-16(18)13(14(21)15(17)19-20)12-8-6-7-11(2)10-12/h6-8,10,13,16H,3-4H2,1-2H3