N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-3-phenylmethoxybenzamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]benzamide Formula: C28H21BrN2O4 MolecularWeight: 529.38134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5)Br

InChI

InChI=1S/C28H21BrN2O4/c1-33-25-12-10-20(15-23(25)29)28-31-24-16-21(11-13-26(24)35-28)30-27(32)19-8-5-9-22(14-19)34-17-18-6-3-2-4-7-18/h2-16H,17H2,1H3,(H,30,32)