(3-methoxy-4-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: (4-hydroxy-3-methoxy-phenyl)methyl-(3-pyridylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-(3-pyridinylmethyl)-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-(pyridin-3-ylmethyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: 3-pyridylmethyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-vanillyl-ammonium Formula: C23H35N3O2+2 MolecularWeight: 385.5429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)[NH+](CC2=CC(=C(C=C2)O)OC)CC3=CN=CC=C3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)[NH+](CC2=CC(=C(C=C2)O)OC)CC3=CN=CC=C3)C

InChI

InChI=1S/C23H33N3O2/c1-22(2)12-19(13-23(3,4)25-22)26(16-18-7-6-10-24-14-18)15-17-8-9-20(27)21(11-17)28-5/h6-11,14,19,25,27H,12-13,15-16H2,1-5H3/p+2