[2,3-bis(chloranyl)phenyl] 3-(1-adamantylcarbonylamino)propanoate

Systemtic Name: [2,3-bis(chloranyl)phenyl] 3-(1-adamantylcarbonylamino)propanoate Openeye Name: (2,3-dichlorophenyl) 3-(adamantane-1-carbonylamino)propanoate CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]propanoic acid (2,3-dichlorophenyl) ester IUPAC Name: (2,3-dichlorophenyl) 3-(adamantane-1-carbonylamino)propanoate Traditional Name: 3-(adamantane-1-carbonylamino)propionic acid (2,3-dichlorophenyl) ester Formula: C20H23Cl2NO3 MolecularWeight: 396.30752

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)OC4=C(C(=CC=C4)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)OC4=C(C(=CC=C4)Cl)Cl

InChI

InChI=1S/C20H23Cl2NO3/c21-15-2-1-3-16(18(15)22)26-17(24)4-5-23-19(25)20-9-12-6-13(10-20)8-14(7-12)11-20/h1-3,12-14H,4-11H2,(H,23,25)