[3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,5-dinitrobenzoate

Systemtic Name: [3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,5-dinitrobenzoate Openeye Name: [3-(cyclohexylcarbamoyl)-2-oxo-chromen-7-yl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(cyclohexylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(cyclohexylcarbamoyl)-2-oxochromen-7-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-(cyclohexylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C23H19N3O9 MolecularWeight: 481.41166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC3=C(C=C(C=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])OC2=O

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(C=C(C=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])OC2=O

InChI

InChI=1S/C23H19N3O9/c27-21(24-15-4-2-1-3-5-15)19-10-13-6-7-18(12-20(13)35-23(19)29)34-22(28)14-8-16(25(30)31)11-17(9-14)26(32)33/h6-12,15H,1-5H2,(H,24,27)