(E)-3-[4-(3-methylbutoxy)phenyl]-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-isopentyloxyphenyl)-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-isoamoxyphenyl)-2-mesyl-acrylonitrile Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=C(C#N)S(=O)(=O)C

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)/C=C(\C#N)/S(=O)(=O)C

InChI

InChI=1S/C15H19NO3S/c1-12(2)8-9-19-14-6-4-13(5-7-14)10-15(11-16)20(3,17)18/h4-7,10,12H,8-9H2,1-3H3/b15-10+