1,3-benzodioxol-5-yl (3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl (3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl (3S)-1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (3S)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-ethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19NO5/c1-2-13-5-3-4-6-16(13)21-11-14(9-19(21)22)20(23)26-15-7-8-17-18(10-15)25-12-24-17/h3-8,10,14H,2,9,11-12H2,1H3/t14-/m0/s1