butyl (E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enoate

Systemtic Name: butyl (E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-acrylic acid butyl ester Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=C(N(N=C1C)C2=CC=CC=C2)Cl)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=C(N(N=C1C)C2=CC=CC=C2)Cl)/C#N

InChI

InChI=1S/C18H18ClN3O2/c1-3-4-10-24-18(23)14(12-20)11-16-13(2)21-22(17(16)19)15-8-6-5-7-9-15/h5-9,11H,3-4,10H2,1-2H3/b14-11+