[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl] 2-benzamidopropanoate

Systemtic Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl] 2-benzamidopropanoate Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-2-oxo-ethyl] 2-benzamidopropanoate CAS Name: 2-benzamidopropanoic acid [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 2-benzamidopropanoate Traditional Name: 2-benzamidopropionic acid [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC(C)C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O6/c1-13(22-20(25)15-6-4-3-5-7-15)21(26)29-14(2)19(24)23-16-8-9-17-18(12-16)28-11-10-27-17/h3-9,12-14H,10-11H2,1-2H3,(H,22,25)(H,23,24)