4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]-N,N-diethyl-benzamide CAS Name: 4-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxopropyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[2-(4-bromo-2,6-dimethylphenoxy)propanoylamino]-N,N-diethylbenzamide Traditional Name: 4-[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]-N,N-diethyl-benzamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C22H27BrN2O3/c1-6-25(7-2)22(27)17-8-10-19(11-9-17)24-21(26)16(5)28-20-14(3)12-18(23)13-15(20)4/h8-13,16H,6-7H2,1-5H3,(H,24,26)