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

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 3-acetamidoadamantane-1-carboxylate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-2-ylamino)-2-oxoethyl] 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid [2-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C23H38N2O4 MolecularWeight: 406.55882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N2O4/c1-15(2)6-5-7-16(3)24-20(27)13-29-21(28)22-9-18-8-19(10-22)12-23(11-18,14-22)25-17(4)26/h15-16,18-19H,5-14H2,1-4H3,(H,24,27)(H,25,26)