ethyl 1-[2-[(2-fluorophenyl)methyl-methylsulfonyl-amino]-4,5-dimethoxy-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(2-fluorophenyl)methyl-methylsulfonyl-amino]-4,5-dimethoxy-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(2-fluorophenyl)methyl-methylsulfonyl-amino]-4,5-dimethoxy-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-[(2-fluorophenyl)methyl-methylsulfonylamino]-4,5-dimethoxyphenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(2-fluorophenyl)methyl-methylsulfonylamino]-4,5-dimethoxybenzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-fluorobenzyl)-mesyl-amino]-4,5-dimethoxy-benzoyl]isonipecotic acid ethyl ester Formula: C25H31FN2O7S MolecularWeight: 522.586243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3F)S(=O)(=O)C)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3F)S(=O)(=O)C)OC)OC

InChI

InChI=1S/C25H31FN2O7S/c1-5-35-25(30)17-10-12-27(13-11-17)24(29)19-14-22(33-2)23(34-3)15-21(19)28(36(4,31)32)16-18-8-6-7-9-20(18)26/h6-9,14-15,17H,5,10-13,16H2,1-4H3