(3-aminocarbonyl-2-oxidanylidene-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate

Systemtic Name: (3-aminocarbonyl-2-oxidanylidene-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate Openeye Name: (3-carbamoyl-2-oxo-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid (3-carbamoyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3-carbamoyl-2-oxochromen-7-yl) 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid (3-carbamoyl-2-keto-chromen-7-yl) ester Formula: C18H11N3O9 MolecularWeight: 413.29464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H11N3O9/c1-8-13(20(25)26)5-10(6-14(8)21(27)28)17(23)29-11-3-2-9-4-12(16(19)22)18(24)30-15(9)7-11/h2-7H,1H3,(H2,19,22)