[4-(methylcarbamoyl)phenyl] 3-(1-adamantylcarbonylamino)propanoate

Systemtic Name: [4-(methylcarbamoyl)phenyl] 3-(1-adamantylcarbonylamino)propanoate Openeye Name: [4-(methylcarbamoyl)phenyl] 3-(adamantane-1-carbonylamino)propanoate CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]propanoic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] 3-(adamantane-1-carbonylamino)propanoate Traditional Name: 3-(adamantane-1-carbonylamino)propionic acid [4-(methylcarbamoyl)phenyl] ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4/c1-23-20(26)17-2-4-18(5-3-17)28-19(25)6-7-24-21(27)22-11-14-8-15(12-22)10-16(9-14)13-22/h2-5,14-16H,6-13H2,1H3,(H,23,26)(H,24,27)