1-[(E)-2-(4-tert-butylcyclohexen-1-yl)ethenyl]azepan-2-one

Systemtic Name: 1-[(E)-2-(4-tert-butylcyclohexen-1-yl)ethenyl]azepan-2-one Openeye Name: 1-[(E)-2-(4-tert-butylcyclohexen-1-yl)vinyl]azepan-2-one CAS Name: 1-[(E)-2-(4-tert-butyl-1-cyclohexenyl)ethenyl]-2-azepanone IUPAC Name: 1-[(E)-2-(4-tert-butylcyclohexen-1-yl)ethenyl]azepan-2-one Traditional Name: 1-[(E)-2-(4-tert-butylcyclohexen-1-yl)vinyl]azepan-2-one Formula: C18H29NO MolecularWeight: 275.42896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=CC1)C=CN2CCCCCC2=O

Isomeric SMILES

CC(C)(C)C1CCC(=CC1)/C=C/N2CCCCCC2=O

InChI

InChI=1S/C18H29NO/c1-18(2,3)16-10-8-15(9-11-16)12-14-19-13-6-4-5-7-17(19)20/h8,12,14,16H,4-7,9-11,13H2,1-3H3/b14-12+