4-(dibutylamino)-3,6-dinitro-chromen-2-one

Systemtic Name: 4-(dibutylamino)-3,6-dinitro-chromen-2-one Openeye Name: 4-(dibutylamino)-3,6-dinitro-chromen-2-one CAS Name: 4-(dibutylamino)-3,6-dinitro-1-benzopyran-2-one IUPAC Name: 4-(dibutylamino)-3,6-dinitrochromen-2-one Traditional Name: 4-(dibutylamino)-3,6-dinitro-coumarin Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C(=O)OC2=C1C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)C1=C(C(=O)OC2=C1C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-3-5-9-18(10-6-4-2)15-13-11-12(19(22)23)7-8-14(13)26-17(21)16(15)20(24)25/h7-8,11H,3-6,9-10H2,1-2H3