4-[4-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(4-methyl-3-nitro-phenyl)-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-keto-2-(4-methyl-3-nitro-phenyl)ethoxy]phenyl]benzonitrile Formula: C22H16N2O4 MolecularWeight: 372.37344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C22H16N2O4/c1-15-2-5-19(12-21(15)24(26)27)22(25)14-28-20-10-8-18(9-11-20)17-6-3-16(13-23)4-7-17/h2-12H,14H2,1H3