(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[1-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-3-oxidanyl-propan-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[1-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-3-oxidanyl-propan-2-yl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[1-[[4-(4-chlorobenzoyl)-1-piperidyl]methyl]-2-hydroxy-ethyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[1-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-3-hydroxypropan-2-yl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[1-[4-(4-chlorobenzoyl)piperidin-1-yl]-3-hydroxypropan-2-yl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[1-[[4-(4-chlorobenzoyl)piperidino]methyl]-2-hydroxy-ethyl]acrylamide Formula: C25H28BrClN2O4 MolecularWeight: 535.85782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC(CN2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl)CO

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC(CN2CCC(CC2)C(=O)C3=CC=C(C=C3)Cl)CO

InChI

InChI=1S/C25H28BrClN2O4/c1-33-23-8-5-20(26)14-19(23)4-9-24(31)28-22(16-30)15-29-12-10-18(11-13-29)25(32)17-2-6-21(27)7-3-17/h2-9,14,18,22,30H,10-13,15-16H2,1H3,(H,28,31)/b9-4+