[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl 5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(p-tolyl)pyrrolidine-3-carboxylic acid [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl ester Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC3=NOC(=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC3=NOC(=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H20N2O6/c1-14-2-5-18(6-3-14)25-11-16(9-22(25)26)23(27)28-12-17-10-20(31-24-17)15-4-7-19-21(8-15)30-13-29-19/h2-8,10,16H,9,11-13H2,1H3