dipropan-2-yl 6-[2-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate

Systemtic Name: dipropan-2-yl 6-[2-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate Openeye Name: diisopropyl 6-[2-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate CAS Name: 6-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxin-2,3-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 6-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate Traditional Name: 6-[2-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxin-2,3-dicarboxylic acid diisopropyl ester Formula: C26H32ClNO7 MolecularWeight: 505.98778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1C(OC2=C(O1)C=CC(=C2)CCNCC(C3=CC(=CC=C3)Cl)O)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C1C(OC2=C(O1)C=CC(=C2)CCNCC(C3=CC(=CC=C3)Cl)O)C(=O)OC(C)C

InChI

InChI=1S/C26H32ClNO7/c1-15(2)32-25(30)23-24(26(31)33-16(3)4)35-22-12-17(8-9-21(22)34-23)10-11-28-14-20(29)18-6-5-7-19(27)13-18/h5-9,12-13,15-16,20,23-24,28-29H,10-11,14H2,1-4H3