3-bromanyl-N-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methyl]aniline

Systemtic Name: 3-bromanyl-N-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methyl]aniline Openeye Name: 3-bromo-N-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methyl]aniline CAS Name: 3-bromo-N-[(4-methoxy-3,5-dimethyl-2-pyridin-1-iumyl)methyl]aniline IUPAC Name: 3-bromo-N-[(4-methoxy-3,5-dimethylpyridin-1-ium-2-yl)methyl]aniline Traditional Name: (3-bromophenyl)-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methyl]amine Formula: C15H18BrN2O+ MolecularWeight: 322.22022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C(=C1OC)C)CNC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C[NH+]=C(C(=C1OC)C)CNC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H17BrN2O/c1-10-8-18-14(11(2)15(10)19-3)9-17-13-6-4-5-12(16)7-13/h4-8,17H,9H2,1-3H3/p+1