3-oxidanylidenebutan-2-yl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: (1-methyl-2-oxo-propyl) 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid (2-keto-1-methyl-propyl) ester Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC(=O)CCNC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C(=O)C)OC(=O)CCNC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H28N2O4/c1-11(21)12(2)24-16(22)3-4-19-17(23)20-18-8-13-5-14(9-18)7-15(6-13)10-18/h12-15H,3-10H2,1-2H3,(H2,19,20,23)