[5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-3-oxidanylidene-cyclohexen-1-yl] 2-methylpropanoate

Systemtic Name: [5-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-3-oxidanylidene-cyclohexen-1-yl] 2-methylpropanoate Openeye Name: [5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-3-oxo-cyclohexen-1-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [5-(5-chloro-1,3-dimethyl-4-pyrazolyl)-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-oxocyclohexen-1-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [5-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-3-keto-cyclohexen-1-yl] ester Formula: C15H19ClN2O3 MolecularWeight: 310.77596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2CC(=CC(=O)C2)OC(=O)C(C)C)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C2CC(=CC(=O)C2)OC(=O)C(C)C)Cl)C

InChI

InChI=1S/C15H19ClN2O3/c1-8(2)15(20)21-12-6-10(5-11(19)7-12)13-9(3)17-18(4)14(13)16/h7-8,10H,5-6H2,1-4H3