2-(azepan-1-ium-1-ylmethyl)-6-methoxy-phenol

Systemtic Name: 2-(azepan-1-ium-1-ylmethyl)-6-methoxy-phenol Openeye Name: 2-(azepan-1-ium-1-ylmethyl)-6-methoxy-phenol CAS Name: 2-(1-azepan-1-iumylmethyl)-6-methoxyphenol IUPAC Name: 2-(azepan-1-ium-1-ylmethyl)-6-methoxyphenol Traditional Name: 2-(azepan-1-ium-1-ylmethyl)-6-methoxy-phenol Formula: C14H22NO2+ MolecularWeight: 236.32998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C[NH+]2CCCCCC2

Isomeric SMILES

COC1=CC=CC(=C1O)C[NH+]2CCCCCC2

InChI

InChI=1S/C14H21NO2/c1-17-13-8-6-7-12(14(13)16)11-15-9-4-2-3-5-10-15/h6-8,16H,2-5,9-11H2,1H3/p+1