[2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-2-ylamino)-2-oxoethyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C21H35NO4 MolecularWeight: 365.5069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)O

Isomeric SMILES

CC(C)CCCC(C)NC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)O

InChI

InChI=1S/C21H35NO4/c1-14(2)5-4-6-15(3)22-18(23)12-26-19(24)20-8-16-7-17(9-20)11-21(25,10-16)13-20/h14-17,25H,4-13H2,1-3H3,(H,22,23)