(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C(=O)N1CCCC1)OC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H33N3O4/c1-14(19(26)24-6-2-3-7-24)28-18(25)4-5-22-20(27)23-21-11-15-8-16(12-21)10-17(9-15)13-21/h14-17H,2-13H2,1H3,(H2,22,23,27)