8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol

Systemtic Name: 8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol Openeye Name: 8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol CAS Name: 8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol IUPAC Name: 8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol Traditional Name: 8-cyclononyl-1,5-bis[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-1,5-diazonan-7-ol Formula: C40H60N2O5 MolecularWeight: 648.9148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCC1)C2CN(CCCN(CC2O)CCCCC3=CC4=C(C=C3)OCCO4)CCCCC5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1CCCCC(CCC1)C2CN(CCCN(CC2O)CCCCC3=CC4=C(C=C3)OCCO4)CCCCC5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C40H60N2O5/c43-36-31-42(21-10-8-13-33-17-19-38-40(29-33)47-27-25-45-38)23-11-22-41(30-35(36)34-14-5-3-1-2-4-6-15-34)20-9-7-12-32-16-18-37-39(28-32)46-26-24-44-37/h16-19,28-29,34-36,43H,1-15,20-27,30-31H2