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

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[4-methyl-3-(propanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[4-methyl-3-(propanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[4-methyl-3-(1-oxopropylamino)phenyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[4-methyl-3-(propanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-isoamoxy-N-(4-methyl-3-propionamido-phenyl)benzamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br)C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br)C

InChI

InChI=1S/C22H27BrN2O3/c1-5-21(26)25-19-13-17(8-6-15(19)4)24-22(27)16-7-9-20(18(23)12-16)28-11-10-14(2)3/h6-9,12-14H,5,10-11H2,1-4H3,(H,24,27)(H,25,26)