3-bromanyl-4-butoxy-N-[3-(butylcarbamoyl)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[3-(butylcarbamoyl)phenyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[3-(butylcarbamoyl)phenyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[3-[butylamino(oxo)methyl]phenyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[3-(butylcarbamoyl)phenyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[3-(butylcarbamoyl)phenyl]benzamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OCCCC)Br

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OCCCC)Br

InChI

InChI=1S/C22H27BrN2O3/c1-3-5-12-24-21(26)16-8-7-9-18(14-16)25-22(27)17-10-11-20(19(23)15-17)28-13-6-4-2/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,24,26)(H,25,27)