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

Systemtic Name: butyl (E)-3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-2-cyano-acrylic acid butyl ester Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=C(N(N=C1C)CC2=CC=CC=C2)Cl)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=C(N(N=C1C)CC2=CC=CC=C2)Cl)/C#N

InChI

InChI=1S/C19H20ClN3O2/c1-3-4-10-25-19(24)16(12-21)11-17-14(2)22-23(18(17)20)13-15-8-6-5-7-9-15/h5-9,11H,3-4,10,13H2,1-2H3/b16-11+