[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 3-phenylbutanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 3-phenylbutanoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] 3-phenylbutanoate CAS Name: 3-phenylbutanoic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3-phenylbutanoate Traditional Name: 3-phenylbutyric acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C19H19NO5 MolecularWeight: 341.35786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO5/c1-13(14-5-3-2-4-6-14)9-19(22)23-11-18(21)20-15-7-8-16-17(10-15)25-12-24-16/h2-8,10,13H,9,11-12H2,1H3,(H,20,21)