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

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(3-ethoxypropyl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(3-ethoxypropyl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-(3-ethoxypropyl)ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(3-ethoxypropyl)azanium Traditional Name: 3-ethoxypropyl(protocatechuyl)ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO3/c1-2-16-7-3-6-13-9-10-4-5-11(14)12(15)8-10/h4-5,8,13-15H,2-3,6-7,9H2,1H3/p+1