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

Systemtic Name: N-butan-2-yl-2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide Openeye Name: 2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide IUPAC Name: N-butan-2-yl-2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide Traditional Name: 2-(2-keto-5-nitro-1,3-benzoxazol-3-yl)-N-sec-butyl-acetamide Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O5/c1-3-8(2)14-12(17)7-15-10-6-9(16(19)20)4-5-11(10)21-13(15)18/h4-6,8H,3,7H2,1-2H3,(H,14,17)