3-(2,5-dimethylphenyl)-2-(2-methylphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(2,5-dimethylphenyl)-2-(2-methylphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(2,5-dimethylphenyl)-2-(o-tolyl)-3-oxo-propanenitrile CAS Name: 3-(2,5-dimethylphenyl)-2-(2-methylphenyl)-3-oxopropanenitrile IUPAC Name: 3-(2,5-dimethylphenyl)-2-(2-methylphenyl)-3-oxopropanenitrile Traditional Name: 3-(2,5-dimethylphenyl)-3-keto-2-(o-tolyl)propionitrile Formula: C18H17NO MolecularWeight: 263.33368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C#N)C2=CC=CC=C2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C(C#N)C2=CC=CC=C2C

InChI

InChI=1S/C18H17NO/c1-12-8-9-14(3)16(10-12)18(20)17(11-19)15-7-5-4-6-13(15)2/h4-10,17H,1-3H3