2-bromanyl-6-methoxy-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-bromanyl-6-methoxy-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2-bromo-6-methoxy-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2-bromo-6-methoxy-4-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2-bromo-6-methoxy-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2-bromo-6-methoxy-4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C19H24BrN2O3+ MolecularWeight: 408.30946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CC(=C(C(=C3)Br)O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CC(=C(C(=C3)Br)O)OC

InChI

InChI=1S/C19H23BrN2O3/c1-24-16-5-3-4-15(12-16)22-8-6-21(7-9-22)13-14-10-17(20)19(23)18(11-14)25-2/h3-5,10-12,23H,6-9,13H2,1-2H3/p+1