1-(7-bromanyldibenzofuran-3-yl)oxy-4-butyl-1-(phenylmethyl)piperidin-1-ium

Systemtic Name: 1-(7-bromanyldibenzofuran-3-yl)oxy-4-butyl-1-(phenylmethyl)piperidin-1-ium Openeye Name: 1-benzyl-1-(7-bromodibenzofuran-3-yl)oxy-4-butyl-piperidin-1-ium CAS Name: 1-[(7-bromo-3-dibenzofuranyl)oxy]-4-butyl-1-(phenylmethyl)piperidin-1-ium IUPAC Name: 1-benzyl-1-(7-bromodibenzofuran-3-yl)oxy-4-butylpiperidin-1-ium Traditional Name: 1-benzyl-1-(7-bromodibenzofuran-3-yl)oxy-4-butyl-piperidin-1-ium Formula: C28H31BrNO2+ MolecularWeight: 493.45524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC[N+](CC1)(CC2=CC=CC=C2)OC3=CC4=C(C=C3)C5=C(O4)C=C(C=C5)Br

Isomeric SMILES

CCCCC1CC[N+](CC1)(CC2=CC=CC=C2)OC3=CC4=C(C=C3)C5=C(O4)C=C(C=C5)Br

InChI

InChI=1S/C28H31BrNO2/c1-2-3-7-21-14-16-30(17-15-21,20-22-8-5-4-6-9-22)32-24-11-13-26-25-12-10-23(29)18-27(25)31-28(26)19-24/h4-6,8-13,18-19,21H,2-3,7,14-17,20H2,1H3/q+1