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

Systemtic Name: N-butan-2-yl-2-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]benzamide Openeye Name: 2-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]benzamide IUPAC Name: N-butan-2-yl-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]-N-sec-butyl-benzamide Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O6/c1-3-14(2)23-21(28)16-7-4-5-8-17(16)24-20(27)9-6-12-25-18-11-10-15(26(30)31)13-19(18)32-22(25)29/h4-5,7-8,10-11,13-14H,3,6,9,12H2,1-2H3,(H,23,28)(H,24,27)