(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl-[2-(2-hydroxyethyloxy)ethyl]azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl-[2-(2-hydroxyethyloxy)ethyl]azanium Openeye Name: (4-benzyloxy-3-bromo-5-methoxy-phenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium CAS Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium IUPAC Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]azanium Traditional Name: (4-benzoxy-3-bromo-5-methoxy-benzyl)-[2-(2-hydroxyethoxy)ethyl]ammonium Formula: C19H25BrNO4+ MolecularWeight: 411.3101

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCOCCO)Br)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCOCCO)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C19H24BrNO4/c1-23-18-12-16(13-21-7-9-24-10-8-22)11-17(20)19(18)25-14-15-5-3-2-4-6-15/h2-6,11-12,21-22H,7-10,13-14H2,1H3/p+1