1,3-benzodioxol-5-yl (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl (3S)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (3S)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C19H17NO5 MolecularWeight: 339.34198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H17NO5/c1-12-2-4-14(5-3-12)20-10-13(8-18(20)21)19(22)25-15-6-7-16-17(9-15)24-11-23-16/h2-7,9,13H,8,10-11H2,1H3/t13-/m0/s1