methyl 1-(4-cyanophenyl)carbonyl-4-phenylmethoxy-pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-cyanophenyl)carbonyl-4-phenylmethoxy-pyrrolidine-2-carboxylate Openeye Name: methyl 4-benzyloxy-1-(4-cyanobenzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(4-cyanophenyl)-oxomethyl]-4-phenylmethoxy-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-cyanobenzoyl)-4-phenylmethoxypyrrolidine-2-carboxylate Traditional Name: 4-benzoxy-1-(4-cyanobenzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1C(=O)C2=CC=C(C=C2)C#N)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CC(CN1C(=O)C2=CC=C(C=C2)C#N)OCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-26-21(25)19-11-18(27-14-16-5-3-2-4-6-16)13-23(19)20(24)17-9-7-15(12-22)8-10-17/h2-10,18-19H,11,13-14H2,1H3