[3,4-bis(oxidanyl)phenyl]methyl-(7-methyloctyl)azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(7-methyloctyl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(7-methyloctyl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-(7-methyloctyl)ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(7-methyloctyl)azanium Traditional Name: 7-methyloctyl(protocatechuyl)ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC[NH2+]CC1=CC(=C(C=C1)O)O

Isomeric SMILES

CC(C)CCCCCC[NH2+]CC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C16H27NO2/c1-13(2)7-5-3-4-6-10-17-12-14-8-9-15(18)16(19)11-14/h8-9,11,13,17-19H,3-7,10,12H2,1-2H3/p+1