(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)-N-(1-methylsulfonylpiperidin-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)-N-(1-methylsulfonylpiperidin-4-yl)prop-2-enamide Openeye Name: (E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)-N-(1-methylsulfonyl-4-piperidyl)prop-2-enamide CAS Name: (E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-N-(1-methylsulfonyl-4-piperidinyl)-2-propenamide IUPAC Name: (E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-N-(1-methylsulfonylpiperidin-4-yl)prop-2-enamide Traditional Name: (E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)-N-(1-mesyl-4-piperidyl)acrylamide Formula: C18H25ClN2O5S MolecularWeight: 416.9195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)NC2CCN(CC2)S(=O)(=O)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)NC2CCN(CC2)S(=O)(=O)C)OC

InChI

InChI=1S/C18H25ClN2O5S/c1-4-26-18-15(19)11-13(12-16(18)25-2)5-6-17(22)20-14-7-9-21(10-8-14)27(3,23)24/h5-6,11-12,14H,4,7-10H2,1-3H3,(H,20,22)/b6-5+