[2-[4-[[2-[(2S,4S)-2-cyano-4-fluoranyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-piperidin-1-yl]-2-oxidanylidene-ethyl] phenyl carbonate

Systemtic Name: [2-[4-[[2-[(2S,4S)-2-cyano-4-fluoranyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-piperidin-1-yl]-2-oxidanylidene-ethyl] phenyl carbonate Openeye Name: [2-[4-[[2-[(2S,4S)-2-cyano-4-fluoro-pyrrolidin-1-yl]-2-oxo-ethyl]amino]-4-methyl-1-piperidyl]-2-oxo-ethyl] phenyl carbonate CAS Name: carbonic acid [2-[4-[[2-[(2S,4S)-2-cyano-4-fluoro-1-pyrrolidinyl]-2-oxoethyl]amino]-4-methyl-1-piperidinyl]-2-oxoethyl] phenyl ester IUPAC Name: [2-[4-[[2-[(2S,4S)-2-cyano-4-fluoropyrrolidin-1-yl]-2-oxoethyl]amino]-4-methylpiperidin-1-yl]-2-oxoethyl] phenyl carbonate Traditional Name: carbonic acid [2-[4-[[2-[(2S,4S)-2-cyano-4-fluoro-pyrrolidino]-2-keto-ethyl]amino]-4-methyl-piperidino]-2-keto-ethyl] phenyl ester Formula: C22H27FN4O5 MolecularWeight: 446.471983

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C(=O)COC(=O)OC2=CC=CC=C2)NCC(=O)N3CC(CC3C#N)F

Isomeric SMILES

CC1(CCN(CC1)C(=O)COC(=O)OC2=CC=CC=C2)NCC(=O)N3C[C@H](C[C@H]3C#N)F

InChI

InChI=1S/C22H27FN4O5/c1-22(25-13-19(28)27-14-16(23)11-17(27)12-24)7-9-26(10-8-22)20(29)15-31-21(30)32-18-5-3-2-4-6-18/h2-6,16-17,25H,7-11,13-15H2,1H3/t16-,17-/m0/s1