(2R)-2-(4-methoxy-3,5-dimethyl-phenyl)azepan-1-ium

Systemtic Name: (2R)-2-(4-methoxy-3,5-dimethyl-phenyl)azepan-1-ium Openeye Name: (2R)-2-(4-methoxy-3,5-dimethyl-phenyl)azepan-1-ium CAS Name: (2R)-2-(4-methoxy-3,5-dimethylphenyl)azepan-1-ium IUPAC Name: (2R)-2-(4-methoxy-3,5-dimethylphenyl)azepan-1-ium Traditional Name: (2R)-2-(4-methoxy-3,5-dimethyl-phenyl)azepan-1-ium Formula: C15H24NO+ MolecularWeight: 234.35716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)C2CCCCC[NH2+]2

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)[C@H]2CCCCC[NH2+]2

InChI

InChI=1S/C15H23NO/c1-11-9-13(10-12(2)15(11)17-3)14-7-5-4-6-8-16-14/h9-10,14,16H,4-8H2,1-3H3/p+1/t14-/m1/s1