2-azanyl-3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]propanoic acid Openeye Name: 2-amino-3-(4,4-dimethyl-2,6-dioxo-cyclohexyl)propanoic acid CAS Name: 2-amino-3-(4,4-dimethyl-2,6-dioxocyclohexyl)propanoic acid IUPAC Name: 2-amino-3-(4,4-dimethyl-2,6-dioxocyclohexyl)propanoic acid Traditional Name: 2-amino-3-(2,6-diketo-4,4-dimethyl-cyclohexyl)propionic acid Formula: C11H17NO4 MolecularWeight: 227.25698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)CC(C(=O)O)N)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)CC(C(=O)O)N)C

InChI

InChI=1S/C11H17NO4/c1-11(2)4-8(13)6(9(14)5-11)3-7(12)10(15)16/h6-7H,3-5,12H2,1-2H3,(H,15,16)