methyl 2-(2-adamantyloxycarbonylamino)-2-methyl-3-(4-phenylphenyl)propanoate

Systemtic Name: methyl 2-(2-adamantyloxycarbonylamino)-2-methyl-3-(4-phenylphenyl)propanoate Openeye Name: methyl 2-(2-adamantyloxycarbonylamino)-2-methyl-3-(4-phenylphenyl)propanoate CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-2-methyl-3-(4-phenylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-(2-adamantyloxycarbonylamino)-2-methyl-3-(4-phenylphenyl)propanoate Traditional Name: 2-(2-adamantyloxycarbonylamino)-2-methyl-3-(4-phenylphenyl)propionic acid methyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33NO4/c1-28(26(30)32-2,17-18-8-10-22(11-9-18)21-6-4-3-5-7-21)29-27(31)33-25-23-13-19-12-20(15-23)16-24(25)14-19/h3-11,19-20,23-25H,12-17H2,1-2H3,(H,29,31)