[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[2-(2-hydroxyethylamino)ethyl]azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[2-(2-hydroxyethylamino)ethyl]azanium Openeye Name: [3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl-[2-(2-hydroxyethylamino)ethyl]ammonium CAS Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[2-(2-hydroxyethylamino)ethyl]ammonium IUPAC Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[2-(2-hydroxyethylamino)ethyl]azanium Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-[2-(2-hydroxyethylamino)ethyl]ammonium Formula: C20H28BrN2O3+ MolecularWeight: 424.35192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrN2O3/c1-15-3-5-16(6-4-15)14-26-20-18(21)11-17(12-19(20)25-2)13-23-8-7-22-9-10-24/h3-6,11-12,22-24H,7-10,13-14H2,1-2H3/p+1