[1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynyl-piperidin-4-yl] phenyl carbonate

Systemtic Name: [1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynyl-piperidin-4-yl] phenyl carbonate Openeye Name: [1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynyl-4-piperidyl] phenyl carbonate CAS Name: carbonic acid [1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynyl-4-piperidinyl] phenyl ester IUPAC Name: [1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynylpiperidin-4-yl] phenyl carbonate Traditional Name: carbonic acid [1-[4,4-bis(4-fluorophenyl)but-3-enyl]-4-ethynyl-4-piperidyl] phenyl ester Formula: C30H27F2NO3 MolecularWeight: 487.537086

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCN(CC1)CCC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)OC(=O)OC4=CC=CC=C4

Isomeric SMILES

C#CC1(CCN(CC1)CCC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)OC(=O)OC4=CC=CC=C4

InChI

InChI=1S/C30H27F2NO3/c1-2-30(36-29(34)35-27-7-4-3-5-8-27)18-21-33(22-19-30)20-6-9-28(23-10-14-25(31)15-11-23)24-12-16-26(32)17-13-24/h1,3-5,7-17H,6,18-22H2