1-[2-(1-bromanylnaphthalen-2-yl)oxyethyl]azepan-1-ium

Systemtic Name: 1-[2-(1-bromanylnaphthalen-2-yl)oxyethyl]azepan-1-ium Openeye Name: 1-[2-[(1-bromo-2-naphthyl)oxy]ethyl]azepan-1-ium CAS Name: 1-[2-[(1-bromo-2-naphthalenyl)oxy]ethyl]azepan-1-ium IUPAC Name: 1-[2-(1-bromonaphthalen-2-yl)oxyethyl]azepan-1-ium Traditional Name: 1-[2-(1-bromo-2-naphthoxy)ethyl]azepan-1-ium Formula: C18H23BrNO+ MolecularWeight: 349.28532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCOC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

C1CCC[NH+](CC1)CCOC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C18H22BrNO/c19-18-16-8-4-3-7-15(16)9-10-17(18)21-14-13-20-11-5-1-2-6-12-20/h3-4,7-10H,1-2,5-6,11-14H2/p+1