[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (3R)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (3R)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] (3R)-1-benzyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (3R)-1-benzyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-benzyl-5-keto-pyrrolidine-3-carboxylic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)OCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1[C@H](CN(C1=O)CC2=CC=CC=C2)C(=O)OCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O6/c24-19(22-16-6-7-17-18(9-16)29-13-28-17)12-27-21(26)15-8-20(25)23(11-15)10-14-4-2-1-3-5-14/h1-7,9,15H,8,10-13H2,(H,22,24)/t15-/m1/s1