butyl (E)-2-cyano-3-[3-(furan-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: butyl (E)-2-cyano-3-[3-(furan-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: butyl (E)-2-cyano-3-[3-(2-furyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-(2-furanyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-2-cyano-3-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-(2-furyl)-1-phenyl-pyrazol-4-yl]acrylic acid butyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CN(N=C1C2=CC=CO2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CN(N=C1C2=CC=CO2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H19N3O3/c1-2-3-11-27-21(25)16(14-22)13-17-15-24(18-8-5-4-6-9-18)23-20(17)19-10-7-12-26-19/h4-10,12-13,15H,2-3,11H2,1H3/b16-13+