[5-(4-bromanyl-2-methyl-phenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [5-(4-bromanyl-2-methyl-phenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [5-(4-bromo-2-methyl-phenyl)-2-furyl]methyl-(3-pyridylmethyl)ammonium CAS Name: [5-(4-bromo-2-methylphenyl)-2-furanyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [5-(4-bromo-2-methylphenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [5-(4-bromo-2-methyl-phenyl)-2-furyl]methyl-(3-pyridylmethyl)ammonium Formula: C18H18BrN2O+ MolecularWeight: 358.25232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C2=CC=C(O2)C[NH2+]CC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C2=CC=C(O2)C[NH2+]CC3=CN=CC=C3

InChI

InChI=1S/C18H17BrN2O/c1-13-9-15(19)4-6-17(13)18-7-5-16(22-18)12-21-11-14-3-2-8-20-10-14/h2-10,21H,11-12H2,1H3/p+1