[4-(4-chloranyl-5-fluoranyl-1-benzofuran-7-yl)-3-methyl-1-(phenylmethyl)piperidin-4-yl] 2-oxidanylidenepropanoate

Systemtic Name: [4-(4-chloranyl-5-fluoranyl-1-benzofuran-7-yl)-3-methyl-1-(phenylmethyl)piperidin-4-yl] 2-oxidanylidenepropanoate Openeye Name: [1-benzyl-4-(4-chloro-5-fluoro-benzofuran-7-yl)-3-methyl-4-piperidyl] 2-oxopropanoate CAS Name: 2-oxopropanoic acid [4-(4-chloro-5-fluoro-7-benzofuranyl)-3-methyl-1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: [1-benzyl-4-(4-chloro-5-fluoro-1-benzofuran-7-yl)-3-methylpiperidin-4-yl] 2-oxopropanoate Traditional Name: 2-ketopropionic acid [1-benzyl-4-(4-chloro-5-fluoro-benzofuran-7-yl)-3-methyl-4-piperidyl] ester Formula: C24H23ClFNO4 MolecularWeight: 443.895123

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C2=CC(=C(C3=C2OC=C3)Cl)F)OC(=O)C(=O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCC1(C2=CC(=C(C3=C2OC=C3)Cl)F)OC(=O)C(=O)C)CC4=CC=CC=C4

InChI

InChI=1S/C24H23ClFNO4/c1-15-13-27(14-17-6-4-3-5-7-17)10-9-24(15,31-23(29)16(2)28)19-12-20(26)21(25)18-8-11-30-22(18)19/h3-8,11-12,15H,9-10,13-14H2,1-2H3