2-[3-(azepan-1-ylcarbonyl)phenoxy]ethylazanium

Systemtic Name: 2-[3-(azepan-1-ylcarbonyl)phenoxy]ethylazanium Openeye Name: 2-[3-(azepane-1-carbonyl)phenoxy]ethylammonium CAS Name: 2-[3-[1-azepanyl(oxo)methyl]phenoxy]ethylammonium IUPAC Name: 2-[3-(azepane-1-carbonyl)phenoxy]ethylazanium Traditional Name: 2-[3-(azepane-1-carbonyl)phenoxy]ethylammonium Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)OCC[NH3+]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)OCC[NH3+]

InChI

InChI=1S/C15H22N2O2/c16-8-11-19-14-7-5-6-13(12-14)15(18)17-9-3-1-2-4-10-17/h5-7,12H,1-4,8-11,16H2/p+1