methyl 4-[[(1R)-2-[[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl]amino]-1-phenyl-ethyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[(1R)-2-[[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl]amino]-1-phenyl-ethyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[(1R)-2-[[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl]amino]-1-phenyl-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[(1R)-2-[[2-[[2-adamantyloxy(oxo)methyl]amino]-2-methyl-1-oxo-3-phenylpropyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[(1R)-2-[[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenylpropanoyl]amino]-1-phenylethyl]amino]-4-oxobutanoate Traditional Name: 4-[[(1R)-2-[[2-(2-adamantyloxycarbonylamino)-2-methyl-3-phenyl-propanoyl]amino]-1-phenyl-ethyl]amino]-4-keto-butyric acid methyl ester Formula: C34H43N3O6 MolecularWeight: 589.72172

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(C(=O)NCC(C2=CC=CC=C2)NC(=O)CCC(=O)OC)NC(=O)OC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(CC1=CC=CC=C1)(C(=O)NC[C@@H](C2=CC=CC=C2)NC(=O)CCC(=O)OC)NC(=O)OC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C34H43N3O6/c1-34(20-22-9-5-3-6-10-22,37-33(41)43-31-26-16-23-15-24(18-26)19-27(31)17-23)32(40)35-21-28(25-11-7-4-8-12-25)36-29(38)13-14-30(39)42-2/h3-12,23-24,26-28,31H,13-21H2,1-2H3,(H,35,40)(H,36,38)(H,37,41)/t23?,24?,26?,27?,28-,31?,34?/m0/s1