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

Systemtic Name: 3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C18H15BrClNO4S MolecularWeight: 456.738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C18H15BrClNO4S/c1-3-25-18-16(19)9-12(10-17(18)24-2)8-15(11-21)26(22,23)14-6-4-13(20)5-7-14/h4-10H,3H2,1-2H3