tert-butyl 4-[3-(1-adamantylcarbonylamino)propanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(1-adamantylcarbonylamino)propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(adamantane-1-carbonylamino)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[[1-adamantyl(oxo)methyl]amino]-1-oxopropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(adamantane-1-carbonylamino)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(adamantane-1-carbonylamino)propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H37N3O4 MolecularWeight: 419.55758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H37N3O4/c1-22(2,3)30-21(29)26-8-6-25(7-9-26)19(27)4-5-24-20(28)23-13-16-10-17(14-23)12-18(11-16)15-23/h16-18H,4-15H2,1-3H3,(H,24,28)