4,5-dimethoxy-N-methyl-2-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]benzamide

Systemtic Name: 4,5-dimethoxy-N-methyl-2-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]benzamide Openeye Name: 4,5-dimethoxy-N-methyl-2-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide CAS Name: 4,5-dimethoxy-N-methyl-2-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]benzamide IUPAC Name: 4,5-dimethoxy-N-methyl-2-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide Traditional Name: 2-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]-4,5-dimethoxy-N-methyl-benzamide Formula: C21H22N4O8 MolecularWeight: 458.42138

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=C(C=C1NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)OC)OC

Isomeric SMILES

CNC(=O)C1=CC(=C(C=C1NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)OC)OC

InChI

InChI=1S/C21H22N4O8/c1-22-20(27)13-10-17(31-2)18(32-3)11-14(13)23-19(26)5-4-8-24-15-7-6-12(25(29)30)9-16(15)33-21(24)28/h6-7,9-11H,4-5,8H2,1-3H3,(H,22,27)(H,23,26)