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

Systemtic Name: 3-bromanyl-N-[3-(butylcarbamoyl)phenyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[3-(butylcarbamoyl)phenyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[3-[butylamino(oxo)methyl]phenyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[3-(butylcarbamoyl)phenyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[3-(butylcarbamoyl)phenyl]-4-propoxy-benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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