(phenylmethyl) 1-[3,4-bis(oxidanyl)phenyl]carbonyl-4-phenylmethoxy-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[3,4-bis(oxidanyl)phenyl]carbonyl-4-phenylmethoxy-pyrrolidine-2-carboxylate Openeye Name: benzyl 4-benzyloxy-1-(3,4-dihydroxybenzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(3,4-dihydroxyphenyl)-oxomethyl]-4-phenylmethoxy-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(3,4-dihydroxybenzoyl)-4-phenylmethoxypyrrolidine-2-carboxylate Traditional Name: 4-benzoxy-1-protocatechuoyl-pyrrolidine-2-carboxylic acid benzyl ester Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)OCC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CN(C1C(=O)OCC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H25NO6/c28-23-12-11-20(13-24(23)29)25(30)27-15-21(32-16-18-7-3-1-4-8-18)14-22(27)26(31)33-17-19-9-5-2-6-10-19/h1-13,21-22,28-29H,14-17H2