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

Systemtic Name: 3-[4-oxidanylidene-3-(phenylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile Openeye Name: 3-(3-benzyl-4-oxo-5,6-dihydrocyclopenta[c]pyrazol-1-yl)propanenitrile CAS Name: 3-[4-oxo-3-(phenylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile IUPAC Name: 3-(3-benzyl-4-oxo-5,6-dihydrocyclopenta[c]pyrazol-1-yl)propanenitrile Traditional Name: 3-(3-benzyl-4-keto-5,6-dihydrocyclopenta[c]pyrazol-1-yl)propionitrile Formula: C16H15N3O MolecularWeight: 265.3098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1N(N=C2CC3=CC=CC=C3)CCC#N

Isomeric SMILES

C1CC(=O)C2=C1N(N=C2CC3=CC=CC=C3)CCC#N

InChI

InChI=1S/C16H15N3O/c17-9-4-10-19-14-7-8-15(20)16(14)13(18-19)11-12-5-2-1-3-6-12/h1-3,5-6H,4,7-8,10-11H2