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

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(isobutylamino)-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-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C1COC2=CC=CC=C2O1

Isomeric SMILES

CC(C)CNC(=O)COC(=O)[C@@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C15H19NO5/c1-10(2)7-16-14(17)9-20-15(18)13-8-19-11-5-3-4-6-12(11)21-13/h3-6,10,13H,7-9H2,1-2H3,(H,16,17)/t13-/m0/s1