ethyl (E)-7-(1-phenylpyrazol-4-yl)hept-2-enoate

Systemtic Name: ethyl (E)-7-(1-phenylpyrazol-4-yl)hept-2-enoate Openeye Name: ethyl (E)-7-(1-phenylpyrazol-4-yl)hept-2-enoate CAS Name: (E)-7-(1-phenyl-4-pyrazolyl)-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(1-phenylpyrazol-4-yl)hept-2-enoate Traditional Name: (E)-7-(1-phenylpyrazol-4-yl)hept-2-enoic acid ethyl ester Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/CCCCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O2/c1-2-22-18(21)13-9-4-3-6-10-16-14-19-20(15-16)17-11-7-5-8-12-17/h5,7-9,11-15H,2-4,6,10H2,1H3/b13-9+