4-butan-2-yl-5-(cyanomethyl)-2-(2-methylpropyl)benzenecarbonitrile

Systemtic Name: 4-butan-2-yl-5-(cyanomethyl)-2-(2-methylpropyl)benzenecarbonitrile Openeye Name: 5-(cyanomethyl)-2-isobutyl-4-sec-butyl-benzonitrile CAS Name: 4-butan-2-yl-5-(cyanomethyl)-2-(2-methylpropyl)benzonitrile IUPAC Name: 4-butan-2-yl-5-(cyanomethyl)-2-(2-methylpropyl)benzonitrile Traditional Name: 5-(cyanomethyl)-2-isobutyl-4-sec-butyl-benzonitrile Formula: C17H22N2 MolecularWeight: 254.36998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2/c1-5-13(4)17-10-15(8-12(2)3)16(11-19)9-14(17)6-7-18/h9-10,12-13H,5-6,8H2,1-4H3