[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] adamantane-1-carboxylate

Systemtic Name: [(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] adamantane-1-carboxylate Openeye Name: [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [(1S)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H26N2O4/c1-22-20(26)23-18(24)17(16-5-3-2-4-6-16)27-19(25)21-10-13-7-14(11-21)9-15(8-13)12-21/h2-6,13-15,17H,7-12H2,1H3,(H2,22,23,24,26)/t13?,14?,15?,17-,21?/m0/s1