[3,4-bis(oxidanyl)phenyl]methyl-(2-pyrrolidin-1-ylethyl)azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(2-pyrrolidin-1-ylethyl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(2-pyrrolidin-1-ylethyl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-[2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(2-pyrrolidin-1-ylethyl)azanium Traditional Name: protocatechuyl(2-pyrrolidinoethyl)ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC[NH2+]CC2=CC(=C(C=C2)O)O

Isomeric SMILES

C1CCN(C1)CC[NH2+]CC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C13H20N2O2/c16-12-4-3-11(9-13(12)17)10-14-5-8-15-6-1-2-7-15/h3-4,9,14,16-17H,1-2,5-8,10H2/p+1