[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl] 2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoate

Systemtic Name: [2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl] 2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoate Openeye Name: [2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl] 2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoate CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-2-methyl-3-phenylpropanoic acid [2-[[2-adamantyloxy(oxo)methyl]amino]-2-methyl-1-oxo-3-phenylpropyl] ester IUPAC Name: [2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenylpropanoyl] 2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenylpropanoate Traditional Name: 2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propionic acid [2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl] ester Formula: C42H52N2O7 MolecularWeight: 696.87148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(C(=O)OC(=O)C(C)(CC2=CC=CC=C2)NC(=O)OC3C4CC5CC(C4)CC3C5)NC(=O)OC6C7CC8CC(C7)CC6C8

Isomeric SMILES

CC(CC1=CC=CC=C1)(C(=O)OC(=O)C(C)(CC2=CC=CC=C2)NC(=O)OC3C4CC5CC(C4)CC3C5)NC(=O)OC6C7CC8CC(C7)CC6C8

InChI

InChI=1S/C42H52N2O7/c1-41(23-25-9-5-3-6-10-25,43-39(47)49-35-31-15-27-13-28(17-31)18-32(35)16-27)37(45)51-38(46)42(2,24-26-11-7-4-8-12-26)44-40(48)50-36-33-19-29-14-30(21-33)22-34(36)20-29/h3-12,27-36H,13-24H2,1-2H3,(H,43,47)(H,44,48)