4-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)-2-oxidanyl-benzoic acid perchlorate

Systemtic Name: 4-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)-2-oxidanyl-benzoic acid perchlorate Openeye Name: 2-hydroxy-4-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)benzoic acid perchlorate CAS Name: 2-hydroxy-4-(2-methyl-4,6-diphenyl-1-pyridin-1-iumyl)benzoic acid perchlorate IUPAC Name: 2-hydroxy-4-(2-methyl-4,6-diphenylpyridin-1-ium-1-yl)benzoic acid perchlorate Traditional Name: 2-hydroxy-4-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)benzoic acid perchlorate Formula: C25H20ClNO7 MolecularWeight: 481.8818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1C2=CC(=C(C=C2)C(=O)O)O)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=CC(=[N+]1C2=CC(=C(C=C2)C(=O)O)O)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C25H19NO3.ClHO4/c1-17-14-20(18-8-4-2-5-9-18)15-23(19-10-6-3-7-11-19)26(17)21-12-13-22(25(28)29)24(27)16-21;2-1(3,4)5/h2-16H,1H3,(H-,27,28,29);(H,2,3,4,5)