[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C20H27BrNO3+ MolecularWeight: 409.33728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]C(C)(C)CO)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]C(C)(C)CO)OC

InChI

InChI=1S/C20H26BrNO3/c1-14-5-7-15(8-6-14)12-25-19-17(21)9-16(10-18(19)24-4)11-22-20(2,3)13-23/h5-10,22-23H,11-13H2,1-4H3/p+1