3-(2,3,5-trimethylphenyl)propanenitrile

Systemtic Name: 3-(2,3,5-trimethylphenyl)propanenitrile Openeye Name: 3-(2,3,5-trimethylphenyl)propanenitrile CAS Name: 3-(2,3,5-trimethylphenyl)propanenitrile IUPAC Name: 3-(2,3,5-trimethylphenyl)propanenitrile Traditional Name: 3-(2,3,5-trimethylphenyl)propionitrile Formula: C12H15N MolecularWeight: 173.2542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N/c1-9-7-10(2)11(3)12(8-9)5-4-6-13/h7-8H,4-5H2,1-3H3