(5E)-5-(chloranylmethylidene)-3,6,6-trimethyl-1-pyridin-2-yl-7H-indazol-4-one

Systemtic Name: (5E)-5-(chloranylmethylidene)-3,6,6-trimethyl-1-pyridin-2-yl-7H-indazol-4-one Openeye Name: (5E)-5-(chloromethylene)-3,6,6-trimethyl-1-(2-pyridyl)-7H-indazol-4-one CAS Name: (5E)-5-(chloromethylidene)-3,6,6-trimethyl-1-(2-pyridinyl)-7H-indazol-4-one IUPAC Name: (5E)-5-(chloromethylidene)-3,6,6-trimethyl-1-pyridin-2-yl-7H-indazol-4-one Traditional Name: (5E)-5-(chloromethylene)-3,6,6-trimethyl-1-(2-pyridyl)-7H-indazol-4-one Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)C(=CCl)C(C2)(C)C)C3=CC=CC=N3

Isomeric SMILES

CC1=NN(C2=C1C(=O)/C(=C/Cl)/C(C2)(C)C)C3=CC=CC=N3

InChI

InChI=1S/C16H16ClN3O/c1-10-14-12(8-16(2,3)11(9-17)15(14)21)20(19-10)13-6-4-5-7-18-13/h4-7,9H,8H2,1-3H3/b11-9-