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(5-bromanyl-2-methoxy-phenyl)methyl-[(4-carboxyphenyl)methyl]azanium chloride

(5-bromanyl-2-methoxy-phenyl)methyl-[(4-carboxyphenyl)methyl]azanium chloride

Systemtic Name:(5-bromanyl-2-methoxy-phenyl)methyl-[(4-carboxyphenyl)methyl]azanium chloride
Openeye Name:(5-bromo-2-methoxy-phenyl)methyl-[(4-carboxyphenyl)methyl]ammonium chloride
CAS Name:(5-bromo-2-methoxyphenyl)methyl-[(4-carboxyphenyl)methyl]ammonium chloride
IUPAC Name:(5-bromo-2-methoxyphenyl)methyl-[(4-carboxyphenyl)methyl]azanium chloride
Traditional Name:(5-bromo-2-methoxy-benzyl)-(4-carboxybenzyl)ammonium chloride
Formula: C16H17BrClNO3
MolecularWeight: 386.66808
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH2+]CC2=CC=C(C=C2)C(=O)O.[Cl-]


Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH2+]CC2=CC=C(C=C2)C(=O)O.[Cl-]


InChI

InChI=1S/C16H16BrNO3.ClH/c1-21-15-7-6-14(17)8-13(15)10-18-9-11-2-4-12(5-3-11)16(19)20;/h2-8,18H,9-10H2,1H3,(H,19,20);1H


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