5-iodanyl-2-methoxy-4-[(5-octyl-1,2,3-triazol-1-yl)methyl]phenol

Systemtic Name: 5-iodanyl-2-methoxy-4-[(5-octyl-1,2,3-triazol-1-yl)methyl]phenol Openeye Name: 5-iodo-2-methoxy-4-[(5-octyltriazol-1-yl)methyl]phenol CAS Name: 5-iodo-2-methoxy-4-[(5-octyl-1-triazolyl)methyl]phenol IUPAC Name: 5-iodo-2-methoxy-4-[(5-octyltriazol-1-yl)methyl]phenol Traditional Name: 5-iodo-2-methoxy-4-[(5-octyltriazol-1-yl)methyl]phenol Formula: C18H26IN3O2 MolecularWeight: 443.32241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=NN1CC2=CC(=C(C=C2I)O)OC

Isomeric SMILES

CCCCCCCCC1=CN=NN1CC2=CC(=C(C=C2I)O)OC

InChI

InChI=1S/C18H26IN3O2/c1-3-4-5-6-7-8-9-15-12-20-21-22(15)13-14-10-18(24-2)17(23)11-16(14)19/h10-12,23H,3-9,13H2,1-2H3