[(2S)-1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [(2S)-1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [(1S)-2-(2,5-dimethoxyanilino)-1-methyl-2-oxo-ethyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [(2S)-1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [(1S)-2-(2,5-dimethoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H19NO7 MolecularWeight: 373.35666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H19NO7/c1-11(18(21)20-14-9-13(23-2)5-7-15(14)24-3)27-19(22)12-4-6-16-17(8-12)26-10-25-16/h4-9,11H,10H2,1-3H3,(H,20,21)/t11-/m0/s1