(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)-1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-1-[4-(morpholine-4-carbonyl)-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-1-[4-[4-morpholinyl(oxo)methyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)-1-[4-(morpholine-4-carbonyl)piperidino]prop-2-en-1-one Formula: C21H27ClN2O5 MolecularWeight: 422.90248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)N2CCC(CC2)C(=O)N3CCOCC3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)N2CCC(CC2)C(=O)N3CCOCC3)Cl)OC

InChI

InChI=1S/C21H27ClN2O5/c1-27-18-14-15(13-17(22)20(18)28-2)3-4-19(25)23-7-5-16(6-8-23)21(26)24-9-11-29-12-10-24/h3-4,13-14,16H,5-12H2,1-2H3/b4-3+