[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(1-adamantylcarbonylamino)propanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(1-adamantylcarbonylamino)propanoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(adamantane-1-carbonylamino)propanoate CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]propanoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(adamantane-1-carbonylamino)propanoate Traditional Name: 3-(adamantane-1-carbonylamino)propionic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O4/c1-3-5-21-18(24)13(2)26-17(23)4-6-22-19(25)20-10-14-7-15(11-20)9-16(8-14)12-20/h3,13-16H,1,4-12H2,2H3,(H,21,24)(H,22,25)/t13-,14?,15?,16?,20?/m1/s1