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

Systemtic Name: (phenylmethyl) 2-[2-[3,4-bis(oxidanyl)phenyl]ethylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[2-(3,4-dihydroxyphenyl)ethylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCCC3=CC(=C(C=C3)O)O

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCCC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C21H24N2O5/c24-18-9-8-15(13-19(18)25)10-11-22-20(26)17-7-4-12-23(17)21(27)28-14-16-5-2-1-3-6-16/h1-3,5-6,8-9,13,17,24-25H,4,7,10-12,14H2,(H,22,26)