(2-morpholin-4-yl-2-oxidanylidene-ethyl) (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate Openeye Name: (2-morpholino-2-oxo-ethyl) (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butanoate CAS Name: (2R)-2-[[1-adamantyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) (2R)-2-(adamantane-1-carbonylamino)-3-methylbutanoate Traditional Name: (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butyric acid (2-keto-2-morpholino-ethyl) ester Formula: C22H34N2O5 MolecularWeight: 406.51576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N1CCOCC1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)N1CCOCC1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H34N2O5/c1-14(2)19(20(26)29-13-18(25)24-3-5-28-6-4-24)23-21(27)22-10-15-7-16(11-22)9-17(8-15)12-22/h14-17,19H,3-13H2,1-2H3,(H,23,27)/t15?,16?,17?,19-,22?/m1/s1