3-[3-(2,6-dimethoxyphenyl)-4-oxidanylidene-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-(2,6-dimethoxyphenyl)-4-oxidanylidene-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile Openeye Name: 3-[3-(2,6-dimethoxyphenyl)-4-oxo-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile CAS Name: 3-[3-(2,6-dimethoxyphenyl)-4-oxo-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile IUPAC Name: 3-[3-(2,6-dimethoxyphenyl)-4-oxo-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile Traditional Name: 3-[3-(2,6-dimethoxyphenyl)-4-keto-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propionitrile Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=NN(C3=C2C(=O)CC3)CCC#N

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=NN(C3=C2C(=O)CC3)CCC#N

InChI

InChI=1S/C17H17N3O3/c1-22-13-5-3-6-14(23-2)16(13)17-15-11(7-8-12(15)21)20(19-17)10-4-9-18/h3,5-6H,4,7-8,10H2,1-2H3