(2S)-2-azanyl-2-[3,5-bis(oxidanyl)-1-adamantyl]-N-(cyanomethyl)-N-ethyl-ethanamide

Systemtic Name: (2S)-2-azanyl-2-[3,5-bis(oxidanyl)-1-adamantyl]-N-(cyanomethyl)-N-ethyl-ethanamide Openeye Name: (2S)-2-amino-N-(cyanomethyl)-2-(3,5-dihydroxy-1-adamantyl)-N-ethyl-acetamide CAS Name: (2S)-2-amino-N-(cyanomethyl)-2-(3,5-dihydroxy-1-adamantyl)-N-ethylacetamide IUPAC Name: (2S)-2-amino-N-(cyanomethyl)-2-(3,5-dihydroxy-1-adamantyl)-N-ethylacetamide Traditional Name: (2S)-2-amino-N-(cyanomethyl)-2-(3,5-dihydroxy-1-adamantyl)-N-ethyl-acetamide Formula: C16H25N3O3 MolecularWeight: 307.388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#N)C(=O)C(C12CC3CC(C1)(CC(C3)(C2)O)O)N

Isomeric SMILES

CCN(CC#N)C(=O)[C@H](C12CC3CC(C1)(CC(C3)(C2)O)O)N

InChI

InChI=1S/C16H25N3O3/c1-2-19(4-3-17)13(20)12(18)14-5-11-6-15(21,8-14)10-16(22,7-11)9-14/h11-12,21-22H,2,4-10,18H2,1H3/t11?,12-,14?,15?,16?/m1/s1