5-[3-methyl-1,2-bis(6-oxidanyl-1,4-dioxepan-5-yl)-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol

Systemtic Name: 5-[3-methyl-1,2-bis(6-oxidanyl-1,4-dioxepan-5-yl)-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol Openeye Name: 5-[1,2-bis(6-hydroxy-1,4-dioxepan-5-yl)-3-methyl-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol CAS Name: 5-[1,2-bis(6-hydroxy-1,4-dioxepan-5-yl)-3-methyl-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol IUPAC Name: 5-[1,2-bis(6-hydroxy-1,4-dioxepan-5-yl)-3-methyl-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol Traditional Name: 5-[1,2-bis(6-hydroxy-1,4-dioxepan-5-yl)-3-methyl-1,4,7-triazonan-2-yl]-1,4-dioxepan-6-ol Formula: C22H41N3O9 MolecularWeight: 491.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CCNCCN1)C2C(COCCO2)O)(C3C(COCCO3)O)C4C(COCCO4)O

Isomeric SMILES

CC1C(N(CCNCCN1)C2C(COCCO2)O)(C3C(COCCO3)O)C4C(COCCO4)O

InChI

InChI=1S/C22H41N3O9/c1-15-22(19-16(26)12-29-6-9-32-19,20-17(27)13-30-7-10-33-20)25(5-4-23-2-3-24-15)21-18(28)14-31-8-11-34-21/h15-21,23-24,26-28H,2-14H2,1H3