5-bromanyl-2-butoxy-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[3-(2-oxolanylmethoxy)phenyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[3-(tetrahydrofurfuryloxy)phenyl]benzamide Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC(=CC=C2)OCC3CCCO3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC(=CC=C2)OCC3CCCO3

InChI

InChI=1S/C22H26BrNO4/c1-2-3-11-27-21-10-9-16(23)13-20(21)22(25)24-17-6-4-7-18(14-17)28-15-19-8-5-12-26-19/h4,6-7,9-10,13-14,19H,2-3,5,8,11-12,15H2,1H3,(H,24,25)