2-methoxy-4-[(E)-(6-methoxy-4-oxidanylidene-chromen-3-ylidene)methyl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[(E)-(6-methoxy-4-oxidanylidene-chromen-3-ylidene)methyl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(E)-(6-methoxy-4-oxo-chroman-3-ylidene)methyl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(E)-(6-methoxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(E)-(6-methoxy-4-oxochromen-3-ylidene)methyl]-6-nitrophenolate Traditional Name: 4-[(E)-(4-keto-6-methoxy-chroman-3-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C18H14NO7- MolecularWeight: 356.30626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=CC3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])C2=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC/C(=C\C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])/C2=O

InChI

InChI=1S/C18H15NO7/c1-24-12-3-4-15-13(8-12)17(20)11(9-26-15)5-10-6-14(19(22)23)18(21)16(7-10)25-2/h3-8,21H,9H2,1-2H3/p-1/b11-5+