4-(1-adamantylamino)-2,3-dimethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1-adamantylamino)-2,3-dimethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(1-adamantylamino)-2,3-dimethyl-4-oxo-butanoic acid CAS Name: 4-(1-adamantylamino)-2,3-dimethyl-4-oxobutanoic acid IUPAC Name: 4-(1-adamantylamino)-2,3-dimethyl-4-oxobutanoic acid Traditional Name: 4-(1-adamantylamino)-4-keto-2,3-dimethyl-butyric acid Formula: C16H25NO3 MolecularWeight: 279.3746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)O)C(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C(C)C(=O)O)C(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C16H25NO3/c1-9(10(2)15(19)20)14(18)17-16-6-11-3-12(7-16)5-13(4-11)8-16/h9-13H,3-8H2,1-2H3,(H,17,18)(H,19,20)