4-(3-methylbutanoylamino)-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]benzamide

Systemtic Name: 4-(3-methylbutanoylamino)-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]benzamide Openeye Name: 4-(3-methylbutanoylamino)-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide CAS Name: 4-[(3-methyl-1-oxobutyl)amino]-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide IUPAC Name: 4-(3-methylbutanoylamino)-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide Traditional Name: 4-(isovalerylamino)-N-[3-(4-keto-3,1-benzoxazin-2-yl)phenyl]benzamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C26H23N3O4/c1-16(2)14-23(30)27-19-12-10-17(11-13-19)24(31)28-20-7-5-6-18(15-20)25-29-22-9-4-3-8-21(22)26(32)33-25/h3-13,15-16H,14H2,1-2H3,(H,27,30)(H,28,31)