2-(3-methyl-2-propan-2-yl-phenyl)ethanenitrile

Systemtic Name: 2-(3-methyl-2-propan-2-yl-phenyl)ethanenitrile Openeye Name: 2-(2-isopropyl-3-methyl-phenyl)acetonitrile CAS Name: 2-(3-methyl-2-propan-2-ylphenyl)acetonitrile IUPAC Name: 2-(3-methyl-2-propan-2-ylphenyl)acetonitrile Traditional Name: 2-(2-isopropyl-3-methyl-phenyl)acetonitrile Formula: C12H15N MolecularWeight: 173.2542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N/c1-9(2)12-10(3)5-4-6-11(12)7-8-13/h4-6,9H,7H2,1-3H3