(2Z)-4-benzamido-2-[(2-methoxyphenyl)methylidene]-3-(4-methylphenyl)-3,4-dihydropyrazol-2-ium-5-olate

Systemtic Name: (2Z)-4-benzamido-2-[(2-methoxyphenyl)methylidene]-3-(4-methylphenyl)-3,4-dihydropyrazol-2-ium-5-olate Openeye Name: (2Z)-4-benzamido-2-[(2-methoxyphenyl)methylene]-3-(p-tolyl)-3,4-dihydropyrazol-2-ium-5-olate CAS Name: (2Z)-4-benzamido-2-[(2-methoxyphenyl)methylidene]-3-(4-methylphenyl)-3,4-dihydropyrazol-2-ium-5-olate IUPAC Name: (2Z)-4-benzamido-2-[(2-methoxyphenyl)methylidene]-3-(4-methylphenyl)-3,4-dihydropyrazol-2-ium-5-olate Traditional Name: (1Z)-4-benzamido-1-o-anisylidene-5-(p-tolyl)-2-pyrazolin-1-ium-3-olate Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=N[N+]2=CC3=CC=CC=C3OC)[O-])NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C\2C(C(=N/[N+]2=C\C3=CC=CC=C3OC)[O-])NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3/c1-17-12-14-18(15-13-17)23-22(26-24(29)19-8-4-3-5-9-19)25(30)27-28(23)16-20-10-6-7-11-21(20)31-2/h3-16,22-23H,1-2H3,(H-,26,27,29,30)/b28-16-