2-(3-methoxy-5-nitro-4-oxidanyl-phenyl)carbonylbenzenecarbonitrile

Systemtic Name: 2-(3-methoxy-5-nitro-4-oxidanyl-phenyl)carbonylbenzenecarbonitrile Openeye Name: 2-(4-hydroxy-3-methoxy-5-nitro-benzoyl)benzonitrile CAS Name: 2-[(4-hydroxy-3-methoxy-5-nitrophenyl)-oxomethyl]benzonitrile IUPAC Name: 2-(4-hydroxy-3-methoxy-5-nitrobenzoyl)benzonitrile Traditional Name: 2-(4-hydroxy-3-methoxy-5-nitro-benzoyl)benzonitrile Formula: C15H10N2O5 MolecularWeight: 298.2503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C(=O)C2=CC=CC=C2C#N

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C15H10N2O5/c1-22-13-7-10(6-12(15(13)19)17(20)21)14(18)11-5-3-2-4-9(11)8-16/h2-7,19H,1H3