2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-propyl-ethanamide

Systemtic Name: 2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-propyl-ethanamide Openeye Name: 2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-propyl-acetamide CAS Name: 2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-propylacetamide IUPAC Name: 2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-propylacetamide Traditional Name: 2-(2-keto-5-nitro-1,3-benzoxazol-3-yl)-N-propyl-acetamide Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CCCNC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C12H13N3O5/c1-2-5-13-11(16)7-14-9-6-8(15(18)19)3-4-10(9)20-12(14)17/h3-4,6H,2,5,7H2,1H3,(H,13,16)