4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium

Systemtic Name: 4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium Openeye Name: 4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium CAS Name: 4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium IUPAC Name: 4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium Traditional Name: 4-[2-(2H-indazol-3-yl)ethyl]-1,4-oxazepan-4-ium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCOC1)CCC2=C3C=CC=CC3=NN2

Isomeric SMILES

C1C[NH+](CCOC1)CCC2=C3C=CC=CC3=NN2

InChI

InChI=1S/C14H19N3O/c1-2-5-13-12(4-1)14(16-15-13)6-8-17-7-3-10-18-11-9-17/h1-2,4-5H,3,6-11H2,(H,15,16)/p+1