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

Systemtic Name: N-[(3-bromanyl-5-chloranyl-2-ethoxy-phenyl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(3-bromo-5-chloro-2-ethoxy-phenyl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(3-bromo-5-chloro-2-ethoxyphenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(3-bromo-5-chloro-2-ethoxyphenyl)methyl]pyridin-1-ium-2-amine Traditional Name: (3-bromo-5-chloro-2-ethoxy-benzyl)-pyridin-1-ium-2-yl-amine Formula: C14H15BrClN2O+ MolecularWeight: 342.6387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1CNC2=CC=CC=[NH+]2)Cl)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1CNC2=CC=CC=[NH+]2)Cl)Br

InChI

InChI=1S/C14H14BrClN2O/c1-2-19-14-10(7-11(16)8-12(14)15)9-18-13-5-3-4-6-17-13/h3-8H,2,9H2,1H3,(H,17,18)/p+1