4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium

Systemtic Name: 4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium Openeye Name: 4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium CAS Name: 4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium IUPAC Name: 4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium Traditional Name: 4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1,4-oxazepan-4-ium Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCOC1)CC2=CN=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCOC1)CC2=CN=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N3O/c1-2-5-13(6-3-1)15-16-11-14(17-15)12-18-7-4-9-19-10-8-18/h1-3,5-6,11H,4,7-10,12H2,(H,16,17)/p+1