propan-2-yl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(3-ethanoyl-1-adamantyl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(3-ethanoyl-1-adamantyl)carbonylamino]propanoate Openeye Name: isopropyl 2-[(3-acetyladamantane-1-carbonyl)amino]-3-[4-(dimethylcarbamoyloxy)phenyl]propanoate CAS Name: 2-[[(3-acetyl-1-adamantyl)-oxomethyl]amino]-3-[4-[dimethylamino(oxo)methoxy]phenyl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-acetyladamantane-1-carbonyl)amino]-3-[4-(dimethylcarbamoyloxy)phenyl]propanoate Traditional Name: 2-[(3-acetyladamantane-1-carbonyl)amino]-3-[4-(dimethylcarbamoyloxy)phenyl]propionic acid isopropyl ester Formula: C28H38N2O6 MolecularWeight: 498.61112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)C(=O)C

Isomeric SMILES

CC(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)C(=O)C

InChI

InChI=1S/C28H38N2O6/c1-17(2)35-24(32)23(11-19-6-8-22(9-7-19)36-26(34)30(4)5)29-25(33)28-14-20-10-21(15-28)13-27(12-20,16-28)18(3)31/h6-9,17,20-21,23H,10-16H2,1-5H3,(H,29,33)