[3-(ethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate

Systemtic Name: [3-(ethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate Openeye Name: [3-(ethylcarbamoyl)-2-oxo-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid [3-(ethylcarbamoyl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(ethylcarbamoyl)-2-oxochromen-7-yl] 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid [3-(ethylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C20H15N3O9 MolecularWeight: 441.3478

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-])OC1=O

Isomeric SMILES

CCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C20H15N3O9/c1-3-21-18(24)14-6-11-4-5-13(9-17(11)32-20(14)26)31-19(25)12-7-15(22(27)28)10(2)16(8-12)23(29)30/h4-9H,3H2,1-2H3,(H,21,24)