3-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate

Systemtic Name: 3-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate Openeye Name: 3-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]benzoate CAS Name: 3-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]benzoate IUPAC Name: 3-[(6-nitro-2-oxochromene-3-carbonyl)amino]benzoate Traditional Name: 3-[(2-keto-6-nitro-chromene-3-carbonyl)amino]benzoate Formula: C17H9N2O7- MolecularWeight: 353.26256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)C(=O)[O-]

InChI

InChI=1S/C17H10N2O7/c20-15(18-11-3-1-2-9(6-11)16(21)22)13-8-10-7-12(19(24)25)4-5-14(10)26-17(13)23/h1-8H,(H,18,20)(H,21,22)/p-1