[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C19H19NO5 MolecularWeight: 341.35786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2COC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)[C@@H]2COC3=CC=CC=C3O2)C

InChI

InChI=1S/C19H19NO5/c1-12-7-13(2)9-14(8-12)20-18(21)11-24-19(22)17-10-23-15-5-3-4-6-16(15)25-17/h3-9,17H,10-11H2,1-2H3,(H,20,21)/t17-/m0/s1