trimethyl 7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]adamantane-1,3,5-tricarboxylate

Systemtic Name: trimethyl 7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]adamantane-1,3,5-tricarboxylate Openeye Name: trimethyl 7-[6-(tert-butoxycarbonylamino)hexanoylamino]adamantane-1,3,5-tricarboxylate CAS Name: 7-[[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]adamantane-1,3,5-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl 7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]adamantane-1,3,5-tricarboxylate Traditional Name: 7-[6-(tert-butoxycarbonylamino)hexanoylamino]adamantane-1,3,5-tricarboxylic acid trimethyl ester Formula: C27H42N2O9 MolecularWeight: 538.63038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCC(=O)NC12CC3(CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCC(=O)NC12CC3(CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C27H42N2O9/c1-23(2,3)38-22(34)28-11-9-7-8-10-18(30)29-27-15-24(19(31)35-4)12-25(16-27,20(32)36-5)14-26(13-24,17-27)21(33)37-6/h7-17H2,1-6H3,(H,28,34)(H,29,30)