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

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(3-methylbutyl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-isopentyl-ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-(3-methylbutyl)ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(3-methylbutyl)azanium Traditional Name: isoamyl(protocatechuyl)ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-9(2)5-6-13-8-10-3-4-11(14)12(15)7-10/h3-4,7,9,13-15H,5-6,8H2,1-2H3/p+1