4-[[(E)-(2-ethoxy-6-nitro-4-oxidanylidene-chromen-3-ylidene)methyl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[[(E)-(2-ethoxy-6-nitro-4-oxidanylidene-chromen-3-ylidene)methyl]amino]-2-oxidanyl-benzoic acid Openeye Name: 4-[[(E)-(2-ethoxy-6-nitro-4-oxo-chroman-3-ylidene)methyl]amino]-2-hydroxy-benzoic acid CAS Name: 4-[[(E)-(2-ethoxy-6-nitro-4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]amino]-2-hydroxybenzoic acid IUPAC Name: 4-[[(E)-(2-ethoxy-6-nitro-4-oxochromen-3-ylidene)methyl]amino]-2-hydroxybenzoic acid Traditional Name: 4-[[(E)-(2-ethoxy-4-keto-6-nitro-chroman-3-ylidene)methyl]amino]-2-hydroxy-benzoic acid Formula: C19H16N2O8 MolecularWeight: 400.33894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(=CNC2=CC(=C(C=C2)C(=O)O)O)C(=O)C3=C(O1)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1/C(=C\NC2=CC(=C(C=C2)C(=O)O)O)/C(=O)C3=C(O1)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O8/c1-2-28-19-14(9-20-10-3-5-12(18(24)25)15(22)7-10)17(23)13-8-11(21(26)27)4-6-16(13)29-19/h3-9,19-20,22H,2H2,1H3,(H,24,25)/b14-9-