4-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(3-nitrophenyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-(3-nitrophenyl)prop-1-enyl]benzonitrile Formula: C16H10N2O3 MolecularWeight: 278.2622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O3/c17-11-13-6-4-12(5-7-13)8-9-16(19)14-2-1-3-15(10-14)18(20)21/h1-10H/b9-8+