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

Systemtic Name: 3-bromanyl-4-butoxy-N-[3-(propylcarbamoyl)phenyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[3-(propylcarbamoyl)phenyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[3-[oxo(propylamino)methyl]phenyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[3-(propylcarbamoyl)phenyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[3-(propylcarbamoyl)phenyl]benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)NCCC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)NCCC)Br

InChI

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