3-chloranyl-N-[2-[[4-(3-methylbutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[[4-(3-methylbutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-chloro-N-[2-[4-(3-methylbutanoylamino)anilino]-2-oxo-ethyl]benzamide CAS Name: 3-chloro-N-[2-[4-[(3-methyl-1-oxobutyl)amino]anilino]-2-oxoethyl]benzamide IUPAC Name: 3-chloro-N-[2-[4-(3-methylbutanoylamino)anilino]-2-oxoethyl]benzamide Traditional Name: 3-chloro-N-[2-[4-(isovalerylamino)anilino]-2-keto-ethyl]benzamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H22ClN3O3/c1-13(2)10-18(25)23-16-6-8-17(9-7-16)24-19(26)12-22-20(27)14-4-3-5-15(21)11-14/h3-9,11,13H,10,12H2,1-2H3,(H,22,27)(H,23,25)(H,24,26)