(2-methoxy-4-methoxycarbonyl-phenyl) 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate

Systemtic Name: (2-methoxy-4-methoxycarbonyl-phenyl) 1-(1-adamantylcarbonyl)pyrrolidine-2-carboxylate Openeye Name: (2-methoxy-4-methoxycarbonyl-phenyl) 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxylic acid (2-methoxy-4-methoxycarbonylphenyl) ester IUPAC Name: (2-methoxy-4-methoxycarbonylphenyl) 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylic acid (4-carbomethoxy-2-methoxy-phenyl) ester Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31NO6/c1-30-21-11-18(22(27)31-2)5-6-20(21)32-23(28)19-4-3-7-26(19)24(29)25-12-15-8-16(13-25)10-17(9-15)14-25/h5-6,11,15-17,19H,3-4,7-10,12-14H2,1-2H3