(4-ethanoylphenyl) 3-(1-adamantylcarbonylamino)propanoate

Systemtic Name: (4-ethanoylphenyl) 3-(1-adamantylcarbonylamino)propanoate Openeye Name: (4-acetylphenyl) 3-(adamantane-1-carbonylamino)propanoate CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]propanoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-(adamantane-1-carbonylamino)propanoate Traditional Name: 3-(adamantane-1-carbonylamino)propionic acid (4-acetylphenyl) ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H27NO4/c1-14(24)18-2-4-19(5-3-18)27-20(25)6-7-23-21(26)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-5,15-17H,6-13H2,1H3,(H,23,26)