N-methyl-4-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-methyl-4-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-methyl-4-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-methyl-4-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-methyl-4-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H20N4O7 MolecularWeight: 440.4061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H20N4O7/c1-22-20(27)18-12-24(14-5-2-3-6-16(14)31-18)19(26)7-4-10-23-15-9-8-13(25(29)30)11-17(15)32-21(23)28/h2-3,5-6,8-9,11,18H,4,7,10,12H2,1H3,(H,22,27)