1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(furan-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(furan-2-ylmethyl)piperazin-4-ium Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)methyl]-4-(2-furylmethyl)piperazin-4-ium CAS Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-(2-furanylmethyl)piperazin-4-ium IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-(furan-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(5-bromo-2-methoxy-benzyl)-4-(2-furfuryl)piperazin-4-ium Formula: C17H22BrN2O2+ MolecularWeight: 366.27278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CN2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CN2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C17H21BrN2O2/c1-21-17-5-4-15(18)11-14(17)12-19-6-8-20(9-7-19)13-16-3-2-10-22-16/h2-5,10-11H,6-9,12-13H2,1H3/p+1