4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)-N-[4-(diethylamino)phenyl]butanamide

Systemtic Name: 4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)-N-[4-(diethylamino)phenyl]butanamide Openeye Name: 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)-N-[4-(diethylamino)phenyl]butanamide CAS Name: 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)-N-[4-(diethylamino)phenyl]butanamide IUPAC Name: 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)-N-[4-(diethylamino)phenyl]butanamide Traditional Name: 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)-N-[4-(diethylamino)phenyl]butyramide Formula: C22H28BrClN2O2 MolecularWeight: 467.82692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C(=C(C(=C2)C)Cl)C)Br

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C(=C(C(=C2)C)Cl)C)Br

InChI

InChI=1S/C22H28BrClN2O2/c1-5-26(6-2)18-11-9-17(10-12-18)25-20(27)8-7-13-28-19-14-15(3)22(24)16(4)21(19)23/h9-12,14H,5-8,13H2,1-4H3,(H,25,27)