2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-propan-2-yl-ethanamide

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-propan-2-ylacetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-8(2)14-12(17)6-15-10-5-9(16(19)20)3-4-11(10)21-7-13(15)18/h3-5,8H,6-7H2,1-2H3,(H,14,17)