N-[3-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-4-chloranyl-phenyl]butanamide

Systemtic Name: N-[3-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-4-chloranyl-phenyl]butanamide Openeye Name: N-[3-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-4-chloro-phenyl]butanamide CAS Name: N-[3-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-4-chlorophenyl]butanamide IUPAC Name: N-[3-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-4-chlorophenyl]butanamide Traditional Name: N-[3-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-4-chloro-phenyl]butyramide Formula: C22H26BrClN2O3 MolecularWeight: 481.81044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C22H26BrClN2O3/c1-5-6-20(27)25-15-8-9-17(24)18(12-15)26-21(28)13-29-19-10-7-14(23)11-16(19)22(2,3)4/h7-12H,5-6,13H2,1-4H3,(H,25,27)(H,26,28)