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

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-22(2)11-15-6-4-3-5-14(15)10-21-19(25)12-23-17-9-16(24(27)28)7-8-18(17)29-13-20(23)26/h3-9H,10-13H2,1-2H3,(H,21,25)