4-bromanyl-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-2-oxidanidyl-pyrazol-2-ium

Systemtic Name: 4-bromanyl-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-2-oxidanidyl-pyrazol-2-ium Openeye Name: 4-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxido-5-(p-tolyl)pyrazol-2-ium CAS Name: 4-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-2-oxidopyrazol-2-ium IUPAC Name: 4-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-2-oxidopyrazol-2-ium Traditional Name: 4-bromo-5-(4-methoxyphenyl)-1-oxido-2-p-anisyl-3-(p-tolyl)pyrazol-1-ium Formula: C25H23BrN2O3 MolecularWeight: 479.36572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=[N+](N2CC3=CC=C(C=C3)OC)[O-])C4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=[N+](N2CC3=CC=C(C=C3)OC)[O-])C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C25H23BrN2O3/c1-17-4-8-19(9-5-17)24-23(26)25(20-10-14-22(31-3)15-11-20)28(29)27(24)16-18-6-12-21(30-2)13-7-18/h4-15H,16H2,1-3H3