3-bromanyl-4-butoxy-N-[2-methyl-3-(propanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[2-methyl-3-(propanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[2-methyl-3-(propanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[2-methyl-3-(1-oxopropylamino)phenyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[2-methyl-3-(propanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-(2-methyl-3-propionamido-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=C(C(=CC=C2)NC(=O)CC)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O3/c1-4-6-12-27-19-11-10-15(13-16(19)22)21(26)24-18-9-7-8-17(14(18)3)23-20(25)5-2/h7-11,13H,4-6,12H2,1-3H3,(H,23,25)(H,24,26)