(2R)-2-(3-ethoxyphenyl)azepan-1-ium

Systemtic Name: (2R)-2-(3-ethoxyphenyl)azepan-1-ium Openeye Name: (2R)-2-(3-ethoxyphenyl)azepan-1-ium CAS Name: (2R)-2-(3-ethoxyphenyl)azepan-1-ium IUPAC Name: (2R)-2-(3-ethoxyphenyl)azepan-1-ium Traditional Name: (2R)-2-m-phenetylazepan-1-ium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2CCCCC[NH2+]2

Isomeric SMILES

CCOC1=CC=CC(=C1)[C@H]2CCCCC[NH2+]2

InChI

InChI=1S/C14H21NO/c1-2-16-13-8-6-7-12(11-13)14-9-4-3-5-10-15-14/h6-8,11,14-15H,2-5,9-10H2,1H3/p+1/t14-/m1/s1