1-isocyano-1-methyl-4-[(2E)-6-methylhepta-2,5-dien-2-yl]cyclohexane

Systemtic Name: 1-isocyano-1-methyl-4-[(2E)-6-methylhepta-2,5-dien-2-yl]cyclohexane Openeye Name: 4-[(1E)-1,5-dimethylhexa-1,4-dienyl]-1-isocyano-1-methyl-cyclohexane CAS Name: 1-isocyano-1-methyl-4-[(2E)-6-methylhepta-2,5-dien-2-yl]cyclohexane IUPAC Name: 1-isocyano-1-methyl-4-[(2E)-6-methylhepta-2,5-dien-2-yl]cyclohexane Traditional Name: 4-[(1E)-1,5-dimethylhexa-1,4-dienyl]-1-isocyano-1-methyl-cyclohexane Formula: C16H25N MolecularWeight: 231.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC=C(C)C1CCC(CC1)(C)[N+]#[C-])C

Isomeric SMILES

CC(=CC/C=C(\C)/C1CCC(CC1)(C)[N+]#[C-])C

InChI

InChI=1S/C16H25N/c1-13(2)7-6-8-14(3)15-9-11-16(4,17-5)12-10-15/h7-8,15H,6,9-12H2,1-4H3/b14-8+