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

Systemtic Name: N-[3-[1-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]ethyl]phenyl]benzamide Openeye Name: N-[3-[1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]ethyl]phenyl]benzamide CAS Name: N-[3-[1-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]ethyl]phenyl]benzamide IUPAC Name: N-[3-[1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]ethyl]phenyl]benzamide Traditional Name: N-[3-[1-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]ethyl]phenyl]benzamide Formula: C26H24N4O6 MolecularWeight: 488.49196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N4O6/c1-17(19-9-5-10-20(15-19)28-25(32)18-7-3-2-4-8-18)27-24(31)11-6-14-29-22-13-12-21(30(34)35)16-23(22)36-26(29)33/h2-5,7-10,12-13,15-17H,6,11,14H2,1H3,(H,27,31)(H,28,32)