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

Systemtic Name: N-methyl-3-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]benzamide Openeye Name: N-methyl-3-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide CAS Name: N-methyl-3-[[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]amino]benzamide IUPAC Name: N-methyl-3-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoylamino]benzamide Traditional Name: 3-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoylamino]-N-methyl-benzamide Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O6/c1-20-18(25)12-4-2-5-13(10-12)21-17(24)6-3-9-22-15-8-7-14(23(27)28)11-16(15)29-19(22)26/h2,4-5,7-8,10-11H,3,6,9H2,1H3,(H,20,25)(H,21,24)