5-bromanyl-N-[4-(3-methylbutanoylamino)phenyl]-2-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-N-[4-(3-methylbutanoylamino)phenyl]-2-oxidanyl-benzamide Openeye Name: 5-bromo-2-hydroxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide CAS Name: 5-bromo-2-hydroxy-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]benzamide IUPAC Name: 5-bromo-2-hydroxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide Traditional Name: 5-bromo-2-hydroxy-N-[4-(isovalerylamino)phenyl]benzamide Formula: C18H19BrN2O3 MolecularWeight: 391.25906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C18H19BrN2O3/c1-11(2)9-17(23)20-13-4-6-14(7-5-13)21-18(24)15-10-12(19)3-8-16(15)22/h3-8,10-11,22H,9H2,1-2H3,(H,20,23)(H,21,24)