[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (5S,7S)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (5S,7S)-3-oxidanyladamantane-1-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] (5S,7S)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7S)-3-hydroxy-1-adamantanecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] (5S,7S)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7S)-3-hydroxyadamantane-1-carboxylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)O

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C12C[C@@H]3C[C@@H](C1)CC(C3)(C2)O

InChI

InChI=1S/C17H24N2O5/c1-2-3-18-15(22)19-13(20)9-24-14(21)16-5-11-4-12(6-16)8-17(23,7-11)10-16/h2,11-12,23H,1,3-10H2,(H2,18,19,20,22)/t11-,12-,16?,17?/m0/s1