(2-oxidanylidene-3-phenyl-chromen-4-yl) 3-nitrobenzoate

Systemtic Name: (2-oxidanylidene-3-phenyl-chromen-4-yl) 3-nitrobenzoate Openeye Name: (2-oxo-3-phenyl-chromen-4-yl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-oxo-3-phenyl-1-benzopyran-4-yl) ester IUPAC Name: (2-oxo-3-phenylchromen-4-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-keto-3-phenyl-chromen-4-yl) ester Formula: C22H13NO6 MolecularWeight: 387.34172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3OC2=O)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3OC2=O)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H13NO6/c24-21(15-9-6-10-16(13-15)23(26)27)29-20-17-11-4-5-12-18(17)28-22(25)19(20)14-7-2-1-3-8-14/h1-13H