N-(1,3-benzodioxol-5-yl)-3-(2-bromanylpropanoylamino)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(2-bromanylpropanoylamino)benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(2-bromopropanoylamino)benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(2-bromo-1-oxopropyl)amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(2-bromopropanoylamino)benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(2-bromopropanoylamino)benzamide Formula: C17H15BrN2O4 MolecularWeight: 391.216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C17H15BrN2O4/c1-10(18)16(21)19-12-4-2-3-11(7-12)17(22)20-13-5-6-14-15(8-13)24-9-23-14/h2-8,10H,9H2,1H3,(H,19,21)(H,20,22)