3-(3-methoxy-2-propan-2-yloxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(3-methoxy-2-propan-2-yloxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(2-isopropoxy-3-methoxy-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-(3-methoxy-2-propan-2-yloxyphenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-methoxy-2-propan-2-yloxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(2-isopropoxy-3-methoxy-phenyl)-2-tosyl-acrylonitrile Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(C(=CC=C2)OC)OC(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(C(=CC=C2)OC)OC(C)C)C#N

InChI

InChI=1S/C20H21NO4S/c1-14(2)25-20-16(6-5-7-19(20)24-4)12-18(13-21)26(22,23)17-10-8-15(3)9-11-17/h5-12,14H,1-4H3