4-[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]phenoxy]benzene-1,2-dicarbonitrile

Systemtic Name: 4-[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]phenoxy]benzene-1,2-dicarbonitrile Openeye Name: 4-[4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]phenoxy]phthalonitrile CAS Name: 4-[4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)iminomethyl]phenoxy]benzene-1,2-dicarbonitrile IUPAC Name: 4-[4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]phenoxy]benzene-1,2-dicarbonitrile Traditional Name: 4-[4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)iminomethyl]phenoxy]phthalonitrile Formula: C26H19N5O2 MolecularWeight: 433.46136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(C=C3)OC4=CC(=C(C=C4)C#N)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(C=C3)OC4=CC(=C(C=C4)C#N)C#N

InChI

InChI=1S/C26H19N5O2/c1-18-25(26(32)31(30(18)2)22-6-4-3-5-7-22)29-17-19-8-11-23(12-9-19)33-24-13-10-20(15-27)21(14-24)16-28/h3-14,17H,1-2H3