N-[3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[3-[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[3-[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]phenyl]-4-tert-butyl-benzamide CAS Name: N-[3-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxopropyl]amino]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[3-[2-(4-bromo-2,6-dimethylphenoxy)propanoylamino]phenyl]-4-tert-butylbenzamide Traditional Name: N-[3-[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]phenyl]-4-tert-butyl-benzamide Formula: C28H31BrN2O3 MolecularWeight: 523.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C)Br

InChI

InChI=1S/C28H31BrN2O3/c1-17-14-22(29)15-18(2)25(17)34-19(3)26(32)30-23-8-7-9-24(16-23)31-27(33)20-10-12-21(13-11-20)28(4,5)6/h7-16,19H,1-6H3,(H,30,32)(H,31,33)