[2-(2,4-diacetamidophenyl)-2-oxidanylidene-ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [2-(2,4-diacetamidophenyl)-2-oxidanylidene-ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(2,4-diacetamidophenyl)-2-oxo-ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(2,4-diacetamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-diacetamidophenyl)-2-oxoethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(2,4-diacetamidophenyl)-2-keto-ethyl] ester Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)COC(=O)C2COC3=CC=CC=C3O2)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)COC(=O)[C@H]2COC3=CC=CC=C3O2)NC(=O)C

InChI

InChI=1S/C21H20N2O7/c1-12(24)22-14-7-8-15(16(9-14)23-13(2)25)17(26)10-29-21(27)20-11-28-18-5-3-4-6-19(18)30-20/h3-9,20H,10-11H2,1-2H3,(H,22,24)(H,23,25)/t20-/m1/s1