2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]propanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]propanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[3-[3-(dimethylamino)-3-oxo-propyl]phenyl]propanamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-[3-(dimethylamino)-3-oxopropyl]phenyl]propanamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-[3-(dimethylamino)-3-oxopropyl]phenyl]propanamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[3-[3-(dimethylamino)-3-keto-propyl]phenyl]propionamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)NC2=CC=CC(=C2)CCC(=O)N(C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)C(=O)NC2=CC=CC(=C2)CCC(=O)N(C)C)C)Br

InChI

InChI=1S/C22H27BrN2O3/c1-14-11-18(23)12-15(2)21(14)28-16(3)22(27)24-19-8-6-7-17(13-19)9-10-20(26)25(4)5/h6-8,11-13,16H,9-10H2,1-5H3,(H,24,27)