(phenylmethyl) 2-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[2-(3,4-diethoxyphenyl)ethylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3)OCC

InChI

InChI=1S/C25H32N2O5/c1-3-30-22-13-12-19(17-23(22)31-4-2)14-15-26-24(28)21-11-8-16-27(21)25(29)32-18-20-9-6-5-7-10-20/h5-7,9-10,12-13,17,21H,3-4,8,11,14-16,18H2,1-2H3,(H,26,28)