3,5-dimethyl-4-propan-2-yl-benzenecarbonitrile

Systemtic Name: 3,5-dimethyl-4-propan-2-yl-benzenecarbonitrile Openeye Name: 4-isopropyl-3,5-dimethyl-benzonitrile CAS Name: 3,5-dimethyl-4-propan-2-ylbenzonitrile IUPAC Name: 3,5-dimethyl-4-propan-2-ylbenzonitrile Traditional Name: 4-isopropyl-3,5-dimethyl-benzonitrile Formula: C12H15N MolecularWeight: 173.2542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(C)C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1C(C)C)C)C#N

InChI

InChI=1S/C12H15N/c1-8(2)12-9(3)5-11(7-13)6-10(12)4/h5-6,8H,1-4H3