N-(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C18H11ClN4O7 MolecularWeight: 430.75554

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC(=C(C=C2O1)NC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1C(=O)NC2=CC(=C(C=C2O1)NC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H11ClN4O7/c19-9-4-11-13(30-7-15(25)21-11)5-10(9)20-14(24)6-22-17(26)8-2-1-3-12(23(28)29)16(8)18(22)27/h1-5H,6-7H2,(H,20,24)(H,21,25)