2-(3,4-dimethoxy-5-nitro-phenyl)-3-(2-phenylethynyl)chromen-4-one

Systemtic Name: 2-(3,4-dimethoxy-5-nitro-phenyl)-3-(2-phenylethynyl)chromen-4-one Openeye Name: 2-(3,4-dimethoxy-5-nitro-phenyl)-3-(2-phenylethynyl)chromen-4-one CAS Name: 2-(3,4-dimethoxy-5-nitrophenyl)-3-(2-phenylethynyl)-1-benzopyran-4-one IUPAC Name: 2-(3,4-dimethoxy-5-nitrophenyl)-3-(2-phenylethynyl)chromen-4-one Traditional Name: 2-(3,4-dimethoxy-5-nitro-phenyl)-3-(2-phenylethynyl)chromone Formula: C25H17NO6 MolecularWeight: 427.40558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=C(C(=O)C3=CC=CC=C3O2)C#CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=C(C(=O)C3=CC=CC=C3O2)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H17NO6/c1-30-22-15-17(14-20(26(28)29)25(22)31-2)24-19(13-12-16-8-4-3-5-9-16)23(27)18-10-6-7-11-21(18)32-24/h3-11,14-15H,1-2H3