[3,4-bis(oxidanyl)phenyl]methyl-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: (1-propylpiperidin-1-ium-4-yl)-protocatechuyl-ammonium Formula: C15H26N2O2+2 MolecularWeight: 266.37914

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC(=C(C=C2)O)O

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C15H24N2O2/c1-2-7-17-8-5-13(6-9-17)16-11-12-3-4-14(18)15(19)10-12/h3-4,10,13,16,18-19H,2,5-9,11H2,1H3/p+2