[3,4-bis(oxidanyl)phenyl]methyl-[(3-fluorophenyl)methyl]azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-[(3-fluorophenyl)methyl]azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-[(3-fluorophenyl)methyl]ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-[(3-fluorophenyl)methyl]ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-[(3-fluorophenyl)methyl]azanium Traditional Name: (3-fluorobenzyl)-protocatechuyl-ammonium Formula: C14H15FNO2+ MolecularWeight: 248.272803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C[NH2+]CC2=CC(=C(C=C2)O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)C[NH2+]CC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C14H14FNO2/c15-12-3-1-2-10(6-12)8-16-9-11-4-5-13(17)14(18)7-11/h1-7,16-18H,8-9H2/p+1