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

Systemtic Name: 2-[2-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-1-oxidanidyl-pyrazol-1-ium-3-yl]benzaldehyde Openeye Name: 2-[2-[(4-methoxyphenyl)methyl]-1-oxido-5-(p-tolyl)pyrazol-1-ium-3-yl]benzaldehyde CAS Name: 2-[2-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-1-oxido-3-pyrazol-1-iumyl]benzaldehyde IUPAC Name: 2-[2-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-1-oxidopyrazol-1-ium-3-yl]benzaldehyde Traditional Name: 2-[1-oxido-2-p-anisyl-5-(p-tolyl)pyrazol-1-ium-3-yl]benzaldehyde Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[N+](N(C(=C2)C3=CC=CC=C3C=O)CC4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=[N+](N(C(=C2)C3=CC=CC=C3C=O)CC4=CC=C(C=C4)OC)[O-]

InChI

InChI=1S/C25H22N2O3/c1-18-7-11-20(12-8-18)24-15-25(23-6-4-3-5-21(23)17-28)26(27(24)29)16-19-9-13-22(30-2)14-10-19/h3-15,17H,16H2,1-2H3