(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-methoxy-4-phenylmethoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-benzyloxy-3-methoxy-phenyl)-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-benzoxy-3-methoxy-phenyl)-2-mesyl-acrylonitrile Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/S(=O)(=O)C)OCC2=CC=CC=C2

InChI

InChI=1S/C18H17NO4S/c1-22-18-11-15(10-16(12-19)24(2,20)21)8-9-17(18)23-13-14-6-4-3-5-7-14/h3-11H,13H2,1-2H3/b16-10+