1-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-methyl-piperidin-1-ium

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-methyl-piperidin-1-ium Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)methyl]-1-methyl-piperidin-1-ium CAS Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-1-methylpiperidin-1-ium IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-1-methylpiperidin-1-ium Traditional Name: 1-(5-bromo-2-methoxy-benzyl)-1-methyl-piperidin-1-ium Formula: C14H21BrNO+ MolecularWeight: 299.22664

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

C[N+]1(CCCCC1)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C14H21BrNO/c1-16(8-4-3-5-9-16)11-12-10-13(15)6-7-14(12)17-2/h6-7,10H,3-5,8-9,11H2,1-2H3/q+1