9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane

Systemtic Name: 9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane Openeye Name: 9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane CAS Name: 9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane IUPAC Name: 9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane Traditional Name: 9-[3-(1,5,9,13,17,22,26-heptazacyclotriacont-9-yl)propyl]-1,5,9,13,17,22,26-heptazacyclotriacontane Formula: C49H110N14 MolecularWeight: 895.4915

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNCCCNCCCN(CCCNCCCNCCCCNCCCNC1)CCCN2CCCNCCCNCCCCNCCCNCCCCNCCCNCCC2

Isomeric SMILES

C1CCNCCCNCCCN(CCCNCCCNCCCCNCCCNC1)CCCN2CCCNCCCNCCCCNCCCNCCCCNCCCNCCC2

InChI

InChI=1S/C49H110N14/c1-5-24-54-32-11-36-58-40-15-44-62(45-16-41-59-37-12-33-55-25-6-2-21-51-29-9-28-50-20-1)48-19-49-63-46-17-42-60-38-13-34-56-26-7-3-22-52-30-10-31-53-23-4-8-27-57-35-14-39-61-43-18-47-63/h50-61H,1-49H2