2,6-bis[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]hexanoic acid

Systemtic Name: 2,6-bis[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]hexanoic acid Openeye Name: 2,6-bis[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]hexanoic acid CAS Name: 2,6-bis[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]hexanoic acid IUPAC Name: 2,6-bis[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]hexanoic acid Traditional Name: 2,6-bis[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]hexanoic acid Formula: C22H34N2O4 MolecularWeight: 390.51636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NCCCCC(C(=O)O)NC2=CC(=O)CC(C2)(C)C)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NCCCCC(C(=O)O)NC2=CC(=O)CC(C2)(C)C)C

InChI

InChI=1S/C22H34N2O4/c1-21(2)11-15(9-17(25)13-21)23-8-6-5-7-19(20(27)28)24-16-10-18(26)14-22(3,4)12-16/h9-10,19,23-24H,5-8,11-14H2,1-4H3,(H,27,28)