[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3,5-bis(bromanyl)-2-methoxy-phenyl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (3,5-dibromo-2-methoxy-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (3,5-dibromo-2-methoxyphenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (3,5-dibromo-2-methoxyphenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (3,5-dibromo-2-methoxy-benzyl)-(3-pyridylmethyl)ammonium Formula: C14H15Br2N2O+ MolecularWeight: 387.0897

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C[NH2+]CC2=CN=CC=C2)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C[NH2+]CC2=CN=CC=C2)Br)Br

InChI

InChI=1S/C14H14Br2N2O/c1-19-14-11(5-12(15)6-13(14)16)9-18-8-10-3-2-4-17-7-10/h2-7,18H,8-9H2,1H3/p+1