5-bromanyl-N-[4-(butanoylamino)phenyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: 5-bromanyl-N-[4-(butanoylamino)phenyl]-2-(2-methylpropoxy)benzamide Openeye Name: 5-bromo-N-[4-(butanoylamino)phenyl]-2-isobutoxy-benzamide CAS Name: 5-bromo-2-(2-methylpropoxy)-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: 5-bromo-N-[4-(butanoylamino)phenyl]-2-(2-methylpropoxy)benzamide Traditional Name: 5-bromo-N-(4-butyramidophenyl)-2-isobutoxy-benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O3/c1-4-5-20(25)23-16-7-9-17(10-8-16)24-21(26)18-12-15(22)6-11-19(18)27-13-14(2)3/h6-12,14H,4-5,13H2,1-3H3,(H,23,25)(H,24,26)