(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-propyl-azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-propyl-azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-propyl-ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-propylammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-propylazanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-propyl-ammonium Formula: C11H17BrNO2+ MolecularWeight: 275.16218

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

Isomeric SMILES

CCC[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

InChI

InChI=1S/C11H16BrNO2/c1-3-4-13-7-8-5-9(12)11(14)10(6-8)15-2/h5-6,13-14H,3-4,7H2,1-2H3/p+1