[5-(4-bromophenyl)furan-2-yl]methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: [5-(4-bromophenyl)furan-2-yl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: [5-(4-bromophenyl)-2-furyl]methyl-(piperidin-1-ium-4-ylmethyl)ammonium CAS Name: [5-(4-bromophenyl)-2-furanyl]methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: [5-(4-bromophenyl)furan-2-yl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: [5-(4-bromophenyl)-2-furyl]methyl-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C17H23BrN2O+2 MolecularWeight: 351.28132

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C[NH2+]CC2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH2+]CCC1C[NH2+]CC2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H21BrN2O/c18-15-3-1-14(2-4-15)17-6-5-16(21-17)12-20-11-13-7-9-19-10-8-13/h1-6,13,19-20H,7-12H2/p+2