5-bromanyl-2-(3-methylbutoxy)-N-[3-(propanoylamino)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-(3-methylbutoxy)-N-[3-(propanoylamino)phenyl]benzamide Openeye Name: 5-bromo-2-isopentyloxy-N-[3-(propanoylamino)phenyl]benzamide CAS Name: 5-bromo-2-(3-methylbutoxy)-N-[3-(1-oxopropylamino)phenyl]benzamide IUPAC Name: 5-bromo-2-(3-methylbutoxy)-N-[3-(propanoylamino)phenyl]benzamide Traditional Name: 5-bromo-2-isoamoxy-N-(3-propionamidophenyl)benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O3/c1-4-20(25)23-16-6-5-7-17(13-16)24-21(26)18-12-15(22)8-9-19(18)27-11-10-14(2)3/h5-9,12-14H,4,10-11H2,1-3H3,(H,23,25)(H,24,26)