4-imidazol-1-yl-6,6-dimethyl-5-oxidanylidene-3-phenyl-heptanenitrile

Systemtic Name: 4-imidazol-1-yl-6,6-dimethyl-5-oxidanylidene-3-phenyl-heptanenitrile Openeye Name: 4-imidazol-1-yl-6,6-dimethyl-5-oxo-3-phenyl-heptanenitrile CAS Name: 4-(1-imidazolyl)-6,6-dimethyl-5-oxo-3-phenylheptanenitrile IUPAC Name: 4-imidazol-1-yl-6,6-dimethyl-5-oxo-3-phenylheptanenitrile Traditional Name: 4-imidazol-1-yl-5-keto-6,6-dimethyl-3-phenyl-enanthonitrile Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(CC#N)C1=CC=CC=C1)N2C=CN=C2

Isomeric SMILES

CC(C)(C)C(=O)C(C(CC#N)C1=CC=CC=C1)N2C=CN=C2

InChI

InChI=1S/C18H21N3O/c1-18(2,3)17(22)16(21-12-11-20-13-21)15(9-10-19)14-7-5-4-6-8-14/h4-8,11-13,15-16H,9H2,1-3H3