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

Systemtic Name: 3-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(4-methyl-3-nitro-phenyl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-keto-2-(4-methyl-3-nitro-phenyl)ethoxy]benzonitrile Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O4/c1-11-5-6-13(8-15(11)18(20)21)16(19)10-22-14-4-2-3-12(7-14)9-17/h2-8H,10H2,1H3