N-[3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-4-chloranyl-phenyl]butanamide

Systemtic Name: N-[3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-4-chloranyl-phenyl]butanamide Openeye Name: N-[3-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-4-chloro-phenyl]butanamide CAS Name: N-[3-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-4-chlorophenyl]butanamide IUPAC Name: N-[3-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-4-chlorophenyl]butanamide Traditional Name: N-[3-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-4-chloro-phenyl]butyramide Formula: C20H22BrClN2O3 MolecularWeight: 453.75728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C20H22BrClN2O3/c1-4-5-18(25)23-15-6-7-16(22)17(10-15)24-19(26)11-27-20-12(2)8-14(21)9-13(20)3/h6-10H,4-5,11H2,1-3H3,(H,23,25)(H,24,26)