4-[[2-(4-bromanylphenoxy)ethanoyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[2-(4-bromanylphenoxy)ethanoyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-(4-bromophenoxy)acetyl]-(2-furylmethyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-(4-bromophenoxy)-1-oxoethyl]-(2-furanylmethyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-(4-bromophenoxy)acetyl]-(furan-2-ylmethyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-(4-bromophenoxy)acetyl]-(2-furfuryl)amino]methyl]-N-methyl-benzamide Formula: C22H21BrN2O4 MolecularWeight: 457.31714

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)C(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H21BrN2O4/c1-24-22(27)17-6-4-16(5-7-17)13-25(14-20-3-2-12-28-20)21(26)15-29-19-10-8-18(23)9-11-19/h2-12H,13-15H2,1H3,(H,24,27)