3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(3-chloro-4-fluoro-anilino)-2-(4-methoxyphenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-(3-chloro-4-fluoroanilino)-2-(4-methoxyphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-chloro-4-fluoroanilino)-2-(4-methoxyphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(3-chloro-4-fluoro-anilino)-2-(4-methoxyphenyl)sulfonyl-acrylonitrile Formula: C16H12ClFN2O3S MolecularWeight: 366.794483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC(=C(C=C2)F)Cl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC(=C(C=C2)F)Cl)C#N

InChI

InChI=1S/C16H12ClFN2O3S/c1-23-12-3-5-13(6-4-12)24(21,22)14(9-19)10-20-11-2-7-16(18)15(17)8-11/h2-8,10,20H,1H3