phenacyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: phenacyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: phenacyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid phenacyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H28N2O4/c25-19(18-4-2-1-3-5-18)14-28-20(26)6-7-23-21(27)24-22-11-15-8-16(12-22)10-17(9-15)13-22/h1-5,15-17H,6-14H2,(H2,23,24,27)