2-(4-cyanophenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: 2-(4-cyanophenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid 2-(4-cyanophenoxy)ethyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCOC4=CC=C(C=C4)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H29N3O4/c24-15-16-1-3-20(4-2-16)29-7-8-30-21(27)5-6-25-22(28)26-23-12-17-9-18(13-23)11-19(10-17)14-23/h1-4,17-19H,5-14H2,(H2,25,26,28)