ethyl (E)-2-cyano-3-[4-(5-phenyl-3,4-dihydropyrazol-2-yl)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[4-(5-phenyl-3,4-dihydropyrazol-2-yl)phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-(5-phenyl-3,4-dihydropyrazol-2-yl)phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(5-phenyl-3,4-dihydropyrazol-2-yl)phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-(5-phenyl-3,4-dihydropyrazol-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(3-phenyl-2-pyrazolin-1-yl)phenyl]acrylic acid ethyl ester Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)N2CCC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)N2CCC(=N2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H19N3O2/c1-2-26-21(25)18(15-22)14-16-8-10-19(11-9-16)24-13-12-20(23-24)17-6-4-3-5-7-17/h3-11,14H,2,12-13H2,1H3/b18-14+