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

Systemtic Name: dicyclohexyl 6-[2-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]ethyl]-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate Openeye Name: dicyclohexyl 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 dicyclohexyl ester IUPAC Name: dicyclohexyl 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 dicyclohexyl ester Formula: C32H40ClNO7 MolecularWeight: 586.1155

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2C(OC3=C(O2)C=CC(=C3)CCNCC(C4=CC(=CC=C4)Cl)O)C(=O)OC5CCCCC5

Isomeric SMILES

C1CCC(CC1)OC(=O)C2C(OC3=C(O2)C=CC(=C3)CCNCC(C4=CC(=CC=C4)Cl)O)C(=O)OC5CCCCC5

InChI

InChI=1S/C32H40ClNO7/c33-23-9-7-8-22(19-23)26(35)20-34-17-16-21-14-15-27-28(18-21)41-30(32(37)39-25-12-5-2-6-13-25)29(40-27)31(36)38-24-10-3-1-4-11-24/h7-9,14-15,18-19,24-26,29-30,34-35H,1-6,10-13,16-17,20H2