(E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(1-methylsulfonyl-4-piperidyl)-3-(2,4,5-trimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-(1-methylsulfonyl-4-piperidinyl)-3-(2,4,5-trimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-asaryl-N-(1-mesyl-4-piperidyl)acrylamide Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)NC2CCN(CC2)S(=O)(=O)C)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)NC2CCN(CC2)S(=O)(=O)C)OC)OC

InChI

InChI=1S/C18H26N2O6S/c1-24-15-12-17(26-3)16(25-2)11-13(15)5-6-18(21)19-14-7-9-20(10-8-14)27(4,22)23/h5-6,11-12,14H,7-10H2,1-4H3,(H,19,21)/b6-5+