4-bromanyl-2-methoxy-6-[(pyridin-1-ium-2-ylamino)methyl]phenol

Systemtic Name: 4-bromanyl-2-methoxy-6-[(pyridin-1-ium-2-ylamino)methyl]phenol Openeye Name: 4-bromo-2-methoxy-6-[(pyridin-1-ium-2-ylamino)methyl]phenol CAS Name: 4-bromo-2-methoxy-6-[(2-pyridin-1-iumylamino)methyl]phenol IUPAC Name: 4-bromo-2-methoxy-6-[(pyridin-1-ium-2-ylamino)methyl]phenol Traditional Name: 4-bromo-2-methoxy-6-[(pyridin-1-ium-2-ylamino)methyl]phenol Formula: C13H14BrN2O2+ MolecularWeight: 310.16646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)CNC2=CC=CC=[NH+]2)O

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)CNC2=CC=CC=[NH+]2)O

InChI

InChI=1S/C13H13BrN2O2/c1-18-11-7-10(14)6-9(13(11)17)8-16-12-4-2-3-5-15-12/h2-7,17H,8H2,1H3,(H,15,16)/p+1