N-[4-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]phenyl]-3-methyl-butyramide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)Br

InChI

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