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

Systemtic Name: N,3-dimethyl-4-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]benzamide Openeye Name: N,3-dimethyl-4-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide CAS Name: N,3-dimethyl-4-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]benzamide IUPAC Name: N,3-dimethyl-4-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide Traditional Name: 4-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]-N,3-dimethyl-benzamide Formula: C20H20N4O6 MolecularWeight: 412.396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C20H20N4O6/c1-12-10-13(19(26)21-2)5-7-15(12)22-18(25)4-3-9-23-16-8-6-14(24(28)29)11-17(16)30-20(23)27/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,26)(H,22,25)