N-[3-(hydroxymethyl)phenyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[3-(hydroxymethyl)phenyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[3-(hydroxymethyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[3-(hydroxymethyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[3-(hydroxymethyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(3-methylolphenyl)acetamide Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NC3=CC=CC(=C3)CO

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NC3=CC=CC(=C3)CO

InChI

InChI=1S/C17H15N3O6/c21-9-11-2-1-3-12(6-11)18-16(22)8-19-14-7-13(20(24)25)4-5-15(14)26-10-17(19)23/h1-7,21H,8-10H2,(H,18,22)