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

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-pentan-3-yl-azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(1-ethylpropyl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-pentan-3-ylammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-pentan-3-ylazanium Traditional Name: 1-ethylpropyl(protocatechuyl)ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-3-10(4-2)13-8-9-5-6-11(14)12(15)7-9/h5-7,10,13-15H,3-4,8H2,1-2H3/p+1