methyl 3-nitro-4-[(3-oxidanylidenebenzo[f]chromen-1-yl)methoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[(3-oxidanylidenebenzo[f]chromen-1-yl)methoxy]benzoate Openeye Name: methyl 3-nitro-4-[(3-oxobenzo[f]chromen-1-yl)methoxy]benzoate CAS Name: 3-nitro-4-[(3-oxo-1-benzo[f][1]benzopyranyl)methoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[(3-oxobenzo[f]chromen-1-yl)methoxy]benzoate Traditional Name: 4-[(3-ketobenzo[f]chromen-1-yl)methoxy]-3-nitro-benzoic acid methyl ester Formula: C22H15NO7 MolecularWeight: 405.357

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H15NO7/c1-28-22(25)14-7-8-18(17(10-14)23(26)27)29-12-15-11-20(24)30-19-9-6-13-4-2-3-5-16(13)21(15)19/h2-11H,12H2,1H3