N-[(3-bromanyl-5-chloranyl-2-methoxy-phenyl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-[(3-bromanyl-5-chloranyl-2-methoxy-phenyl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(3-bromo-5-chloro-2-methoxy-phenyl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(3-bromo-5-chloro-2-methoxyphenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(3-bromo-5-chloro-2-methoxyphenyl)methyl]pyridin-1-ium-2-amine Traditional Name: (3-bromo-5-chloro-2-methoxy-benzyl)-pyridin-1-ium-2-yl-amine Formula: C13H13BrClN2O+ MolecularWeight: 328.61212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CNC2=CC=CC=[NH+]2)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1CNC2=CC=CC=[NH+]2)Cl)Br

InChI

InChI=1S/C13H12BrClN2O/c1-18-13-9(6-10(15)7-11(13)14)8-17-12-4-2-3-5-16-12/h2-7H,8H2,1H3,(H,16,17)/p+1