(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-N-(3-methylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-N-(3-methylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-N-(3-methylsulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-N-(3-methylsulfonylphenyl)-2-propenamide IUPAC Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-N-(3-methylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-N-(3-mesylphenyl)acrylamide Formula: C18H18ClNO5S MolecularWeight: 395.85722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)NC2=CC(=CC=C2)S(=O)(=O)C)Cl)OC

InChI

InChI=1S/C18H18ClNO5S/c1-24-16-10-12(9-15(19)18(16)25-2)7-8-17(21)20-13-5-4-6-14(11-13)26(3,22)23/h4-11H,1-3H3,(H,20,21)/b8-7+