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

Systemtic Name: [2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(4-morpholinoanilino)-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-[4-(4-morpholinyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylanilino)-2-oxoethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-keto-2-(4-morpholinoanilino)ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)COC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)COC(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N2O6/c24-20(22-15-5-7-16(8-6-15)23-9-11-26-12-10-23)14-28-21(25)19-13-27-17-3-1-2-4-18(17)29-19/h1-8,19H,9-14H2,(H,22,24)/t19-/m1/s1