(E)-3-(2-methyl-5-propan-2-yl-cyclohexen-1-yl)but-2-enenitrile

Systemtic Name: (E)-3-(2-methyl-5-propan-2-yl-cyclohexen-1-yl)but-2-enenitrile Openeye Name: (E)-3-(5-isopropyl-2-methyl-cyclohexen-1-yl)but-2-enenitrile CAS Name: (E)-3-(2-methyl-5-propan-2-yl-1-cyclohexenyl)-2-butenenitrile IUPAC Name: (E)-3-(2-methyl-5-propan-2-ylcyclohexen-1-yl)but-2-enenitrile Traditional Name: (E)-3-(5-isopropyl-2-methyl-cyclohexen-1-yl)but-2-enenitrile Formula: C14H21N MolecularWeight: 203.32324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N/c1-10(2)13-6-5-11(3)14(9-13)12(4)7-8-15/h7,10,13H,5-6,9H2,1-4H3/b12-7+