ethyl 4-[1-[2,5-bis(fluoranyl)phenyl]sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[2,5-bis(fluoranyl)phenyl]sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(2,5-difluorophenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2,5-difluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2,5-difluorophenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2,5-difluorophenyl)sulfonylisonipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H25F2N3O5S MolecularWeight: 445.480706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C19H25F2N3O5S/c1-2-29-19(26)23-11-9-22(10-12-23)18(25)14-5-7-24(8-6-14)30(27,28)17-13-15(20)3-4-16(17)21/h3-4,13-14H,2,5-12H2,1H3