2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-propan-2-yloxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-propan-2-yloxy-phenyl)prop-2-enenitrile Openeye Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-isopropoxy-phenyl)prop-2-enenitrile CAS Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-propan-2-yloxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enenitrile Traditional Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-isopropoxy-phenyl)acrylonitrile Formula: C20H20ClNO4S MolecularWeight: 405.8951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OC(C)C

InChI

InChI=1S/C20H20ClNO4S/c1-4-25-20-12-15(5-10-19(20)26-14(2)3)11-18(13-22)27(23,24)17-8-6-16(21)7-9-17/h5-12,14H,4H2,1-3H3