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

Systemtic Name: 3-[[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]methyl]-N-phenyl-benzamide Openeye Name: 3-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]methyl]-N-phenyl-benzamide CAS Name: 3-[[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]methyl]-N-phenylbenzamide IUPAC Name: 3-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]methyl]-N-phenylbenzamide Traditional Name: 3-[[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]methyl]-N-phenyl-benzamide Formula: C25H22N4O6 MolecularWeight: 474.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CNC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CNC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C25H22N4O6/c30-23(10-5-13-28-21-12-11-20(29(33)34)15-22(21)35-25(28)32)26-16-17-6-4-7-18(14-17)24(31)27-19-8-2-1-3-9-19/h1-4,6-9,11-12,14-15H,5,10,13,16H2,(H,26,30)(H,27,31)