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

Systemtic Name: 2-bromanyl-6-methoxy-4-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2-bromo-6-methoxy-4-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2-bromo-6-methoxy-4-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2-bromo-6-methoxy-4-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2-bromo-6-methoxy-4-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C19H24BrN2O2+ MolecularWeight: 392.31006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=C(C(=C3)Br)O)OC

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=C(C(=C3)Br)O)OC

InChI

InChI=1S/C19H23BrN2O2/c1-14-5-3-4-6-17(14)22-9-7-21(8-10-22)13-15-11-16(20)19(23)18(12-15)24-2/h3-6,11-12,23H,7-10,13H2,1-2H3/p+1