(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(phenylmethyl)azanium

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methyl]ammonium CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]azanium Traditional Name: benzyl-(3-bromo-4-ethoxy-5-methoxy-benzyl)ammonium Formula: C17H21BrNO2+ MolecularWeight: 351.25814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]CC2=CC=CC=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]CC2=CC=CC=C2)OC

InChI

InChI=1S/C17H20BrNO2/c1-3-21-17-15(18)9-14(10-16(17)20-2)12-19-11-13-7-5-4-6-8-13/h4-10,19H,3,11-12H2,1-2H3/p+1