4-[(E)-2-(3-methanoyl-5-nitro-4-oxidanyl-phenyl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-(3-methanoyl-5-nitro-4-oxidanyl-phenyl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(3-formyl-4-hydroxy-5-nitro-phenyl)vinyl]benzonitrile CAS Name: 4-[(E)-2-(3-formyl-4-hydroxy-5-nitrophenyl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-2-(3-formyl-4-hydroxy-5-nitrophenyl)ethenyl]benzonitrile Traditional Name: 4-[(E)-2-(3-formyl-4-hydroxy-5-nitro-phenyl)vinyl]benzonitrile Formula: C16H10N2O4 MolecularWeight: 294.2616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC(=C(C(=C2)[N+](=O)[O-])O)C=O)C#N

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O4/c17-9-12-4-1-11(2-5-12)3-6-13-7-14(10-19)16(20)15(8-13)18(21)22/h1-8,10,20H/b6-3+