[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: [2-(N-isopropylanilino)-2-oxo-ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid [2-oxo-2-(N-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-propan-2-ylanilino)ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid [2-(N-isopropylanilino)-2-keto-ethyl] ester Formula: C19H18ClNO5 MolecularWeight: 375.80292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C19H18ClNO5/c1-12(2)21(14-6-4-3-5-7-14)17(22)10-24-19(23)13-8-15(20)18-16(9-13)25-11-26-18/h3-9,12H,10-11H2,1-2H3