methyl (E)-3-[5-chloranyl-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[5-chloranyl-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-4-pyrazolyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methylpyrazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]-2-cyano-acrylic acid methyl ester Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)C=C(C#N)C(=O)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)/C=C(\C#N)/C(=O)OC)Cl

InChI

InChI=1S/C17H16ClN3O2/c1-10-5-6-11(2)15(7-10)21-16(18)14(12(3)20-21)8-13(9-19)17(22)23-4/h5-8H,1-4H3/b13-8+