[(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] 3-(1-adamantyl)benzoate

Systemtic Name: [(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] 3-(1-adamantyl)benzoate Openeye Name: [tert-butoxycarbonyl-[(4-methoxyphenyl)methyl]amino] 3-(1-adamantyl)benzoate CAS Name: 3-(1-adamantyl)benzoic acid [(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(4-methoxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino] 3-(1-adamantyl)benzoate Traditional Name: 3-(1-adamantyl)benzoic acid [tert-butoxycarbonyl(p-anisyl)amino] ester Formula: C30H37NO5 MolecularWeight: 491.61848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)OC)OC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)OC)OC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C30H37NO5/c1-29(2,3)35-28(33)31(19-20-8-10-26(34-4)11-9-20)36-27(32)24-6-5-7-25(15-24)30-16-21-12-22(17-30)14-23(13-21)18-30/h5-11,15,21-23H,12-14,16-19H2,1-4H3