3-(4-methoxy-3-nitro-phenyl)-1-phenyl-prop-2-yn-1-one

Systemtic Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-prop-2-yn-1-one Openeye Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-prop-2-yn-1-one CAS Name: 3-(4-methoxy-3-nitrophenyl)-1-phenyl-2-propyn-1-one IUPAC Name: 3-(4-methoxy-3-nitrophenyl)-1-phenylprop-2-yn-1-one Traditional Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-prop-2-yn-1-one Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C#CC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C#CC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO4/c1-21-16-10-8-12(11-14(16)17(19)20)7-9-15(18)13-5-3-2-4-6-13/h2-6,8,10-11H,1H3