4-morpholin-4-yl-3,6-dinitro-chromen-2-one

Systemtic Name: 4-morpholin-4-yl-3,6-dinitro-chromen-2-one Openeye Name: 4-morpholino-3,6-dinitro-chromen-2-one CAS Name: 4-(4-morpholinyl)-3,6-dinitro-1-benzopyran-2-one IUPAC Name: 4-morpholin-4-yl-3,6-dinitrochromen-2-one Traditional Name: 4-morpholino-3,6-dinitro-coumarin Formula: C13H11N3O7 MolecularWeight: 321.24234

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=O)OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=O)OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O7/c17-13-12(16(20)21)11(14-3-5-22-6-4-14)9-7-8(15(18)19)1-2-10(9)23-13/h1-2,7H,3-6H2