3-[3-(2-methylpropyl)phenyl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[3-(2-methylpropyl)phenyl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-isobutylphenyl)-3-oxo-propanenitrile CAS Name: 3-[3-(2-methylpropyl)phenyl]-3-oxopropanenitrile IUPAC Name: 3-[3-(2-methylpropyl)phenyl]-3-oxopropanenitrile Traditional Name: 3-(3-isobutylphenyl)-3-keto-propionitrile Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-10(2)8-11-4-3-5-12(9-11)13(15)6-7-14/h3-5,9-10H,6,8H2,1-2H3