(5-methoxy-2-oxidanyl-phenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (5-methoxy-2-oxidanyl-phenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: (2-hydroxy-5-methoxy-phenyl)methyl-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: (2-hydroxy-5-methoxyphenyl)methyl-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (2-hydroxy-5-methoxyphenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: (2-hydroxy-5-methoxy-benzyl)-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2/c1-3-8-18-9-6-14(7-10-18)17-12-13-11-15(20-2)4-5-16(13)19/h4-5,11,14,17,19H,3,6-10,12H2,1-2H3/p+2