3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(4-benzoxy-3-bromo-5-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C23H17BrClNO4S MolecularWeight: 518.80738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H17BrClNO4S/c1-29-22-13-17(12-21(24)23(22)30-15-16-5-3-2-4-6-16)11-20(14-26)31(27,28)19-9-7-18(25)8-10-19/h2-13H,15H2,1H3