3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-N-propyl-benzamide

Systemtic Name: 3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-N-propyl-benzamide Openeye Name: 3-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-propyl-benzamide CAS Name: 3-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-N-propylbenzamide IUPAC Name: 3-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-N-propylbenzamide Traditional Name: 3-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-propyl-benzamide Formula: C20H23BrN2O3 MolecularWeight: 419.31222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C20H23BrN2O3/c1-4-8-22-20(25)15-6-5-7-17(11-15)23-18(24)12-26-19-13(2)9-16(21)10-14(19)3/h5-7,9-11H,4,8,12H2,1-3H3,(H,22,25)(H,23,24)