[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 4-(1-adamantylcarbonylamino)butanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 4-(1-adamantylcarbonylamino)butanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 4-(adamantane-1-carbonylamino)butanoate CAS Name: 4-[[1-adamantyl(oxo)methyl]amino]butanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 4-(adamantane-1-carbonylamino)butanoate Traditional Name: 4-(adamantane-1-carbonylamino)butyric acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)CCCNC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)CCCNC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C20H32N2O4/c1-3-21-18(24)13(2)26-17(23)5-4-6-22-19(25)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,3-12H2,1-2H3,(H,21,24)(H,22,25)/t13-,14?,15?,16?,20?/m0/s1