(3-aminocarbonyl-2-oxidanylidene-chromen-7-yl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (3-aminocarbonyl-2-oxidanylidene-chromen-7-yl) 4-chloranyl-3-nitro-benzoate Openeye Name: (3-carbamoyl-2-oxo-chromen-7-yl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (3-carbamoyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3-carbamoyl-2-oxochromen-7-yl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (3-carbamoyl-2-keto-chromen-7-yl) ester Formula: C17H9ClN2O7 MolecularWeight: 388.71556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H9ClN2O7/c18-12-4-2-9(6-13(12)20(24)25)16(22)26-10-3-1-8-5-11(15(19)21)17(23)27-14(8)7-10/h1-7H,(H2,19,21)