2-[[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxo-prop-1-enyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxoprop-1-enyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxoprop-1-enyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[(E)-2-cyano-3-keto-3-(3-nitrophenyl)prop-1-enyl]phenoxy]methyl]benzonitrile Formula: C24H15N3O4 MolecularWeight: 409.3936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H15N3O4/c25-14-19-4-1-2-5-20(19)16-31-23-10-8-17(9-11-23)12-21(15-26)24(28)18-6-3-7-22(13-18)27(29)30/h1-13H,16H2/b21-12+