3-bromanyl-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-4-ethoxy-benzamide Formula: C26H25BrN2O3 MolecularWeight: 493.3923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)C(C)(C)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)C(C)(C)C)Br

InChI

InChI=1S/C26H25BrN2O3/c1-5-31-22-12-8-17(14-20(22)27)24(30)28-19-11-13-23-21(15-19)29-25(32-23)16-6-9-18(10-7-16)26(2,3)4/h6-15H,5H2,1-4H3,(H,28,30)