[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2R)-1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2R)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1CCCN1C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C#CCNC(=O)COC(=O)[C@H]1CCCN1C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H28N2O4/c1-2-5-22-18(24)13-27-19(25)17-4-3-6-23(17)20(26)21-10-14-7-15(11-21)9-16(8-14)12-21/h1,14-17H,3-13H2,(H,22,24)/t14?,15?,16?,17-,21?/m1/s1