methyl 4-[(3S)-3-[(4-oxidanyl-1-adamantyl)carbonylamino]piperidin-1-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: methyl 4-[(3S)-3-[(4-oxidanyl-1-adamantyl)carbonylamino]piperidin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: methyl 4-[(3S)-3-[(4-hydroxyadamantane-1-carbonyl)amino]piperidine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[(3S)-3-[[(4-hydroxy-1-adamantyl)-oxomethyl]amino]-1-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-[(4-hydroxyadamantane-1-carbonyl)amino]piperidine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[(3S)-3-[(4-hydroxyadamantane-1-carbonyl)amino]piperidine-1-carbonyl]piperazine-1-carboxylic acid methyl ester Formula: C23H36N4O5 MolecularWeight: 448.55574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C(=O)N2CCCC(C2)NC(=O)C34CC5CC(C3)C(C(C5)C4)O

Isomeric SMILES

COC(=O)N1CCN(CC1)C(=O)N2CCC[C@@H](C2)NC(=O)C34CC5CC(C3)C(C(C5)C4)O

InChI

InChI=1S/C23H36N4O5/c1-32-22(31)26-7-5-25(6-8-26)21(30)27-4-2-3-18(14-27)24-20(29)23-11-15-9-16(12-23)19(28)17(10-15)13-23/h15-19,28H,2-14H2,1H3,(H,24,29)/t15?,16?,17?,18-,19?,23?/m0/s1