methyl 2-[5-bromanyl-2-[2-[4-cyano-4-[(4-fluorophenyl)methyl]piperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[5-bromanyl-2-[2-[4-cyano-4-[(4-fluorophenyl)methyl]piperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]ethanoate Openeye Name: methyl 2-[5-bromo-2-[2-[4-cyano-4-[(4-fluorophenyl)methyl]-1-piperidyl]-2-oxo-ethoxy]phenyl]acetate CAS Name: 2-[5-bromo-2-[2-[4-cyano-4-[(4-fluorophenyl)methyl]-1-piperidinyl]-2-oxoethoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-bromo-2-[2-[4-cyano-4-[(4-fluorophenyl)methyl]piperidin-1-yl]-2-oxoethoxy]phenyl]acetate Traditional Name: 2-[5-bromo-2-[2-[4-cyano-4-(4-fluorobenzyl)piperidino]-2-keto-ethoxy]phenyl]acetic acid methyl ester Formula: C24H24BrFN2O4 MolecularWeight: 503.360763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C=CC(=C1)Br)OCC(=O)N2CCC(CC2)(CC3=CC=C(C=C3)F)C#N

Isomeric SMILES

COC(=O)CC1=C(C=CC(=C1)Br)OCC(=O)N2CCC(CC2)(CC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C24H24BrFN2O4/c1-31-23(30)13-18-12-19(25)4-7-21(18)32-15-22(29)28-10-8-24(16-27,9-11-28)14-17-2-5-20(26)6-3-17/h2-7,12H,8-11,13-15H2,1H3