4-(4,4-dimethyl-5-oxidanylidene-2-phenyl-pyrazolidin-1-yl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(4,4-dimethyl-5-oxidanylidene-2-phenyl-pyrazolidin-1-yl)carbonylbenzenecarbonitrile Openeye Name: 4-(4,4-dimethyl-5-oxo-2-phenyl-pyrazolidine-1-carbonyl)benzonitrile CAS Name: 4-[(4,4-dimethyl-5-oxo-2-phenyl-1-pyrazolidinyl)-oxomethyl]benzonitrile IUPAC Name: 4-(4,4-dimethyl-5-oxo-2-phenylpyrazolidine-1-carbonyl)benzonitrile Traditional Name: 4-(5-keto-4,4-dimethyl-2-phenyl-pyrazolidine-1-carbonyl)benzonitrile Formula: C19H17N3O2 MolecularWeight: 319.35718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N(C1=O)C(=O)C2=CC=C(C=C2)C#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CN(N(C1=O)C(=O)C2=CC=C(C=C2)C#N)C3=CC=CC=C3)C

InChI

InChI=1S/C19H17N3O2/c1-19(2)13-21(16-6-4-3-5-7-16)22(18(19)24)17(23)15-10-8-14(12-20)9-11-15/h3-11H,13H2,1-2H3