[2-(2-ethoxyethoxy)-1-phenyl-ethyl] 4-(1-adamantylcarbamoylamino)butanoate

Systemtic Name: [2-(2-ethoxyethoxy)-1-phenyl-ethyl] 4-(1-adamantylcarbamoylamino)butanoate Openeye Name: [2-(2-ethoxyethoxy)-1-phenyl-ethyl] 4-(1-adamantylcarbamoylamino)butanoate CAS Name: 4-[[(1-adamantylamino)-oxomethyl]amino]butanoic acid [2-(2-ethoxyethoxy)-1-phenylethyl] ester IUPAC Name: [2-(2-ethoxyethoxy)-1-phenylethyl] 4-(1-adamantylcarbamoylamino)butanoate Traditional Name: 4-(1-adamantylcarbamoylamino)butyric acid [2-(2-ethoxyethoxy)-1-phenyl-ethyl] ester Formula: C27H40N2O5 MolecularWeight: 472.6169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCOCC(C1=CC=CC=C1)OC(=O)CCCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOCCOCC(C1=CC=CC=C1)OC(=O)CCCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H40N2O5/c1-2-32-11-12-33-19-24(23-7-4-3-5-8-23)34-25(30)9-6-10-28-26(31)29-27-16-20-13-21(17-27)15-22(14-20)18-27/h3-5,7-8,20-22,24H,2,6,9-19H2,1H3,(H2,28,29,31)