N-(5-chloranyl-2-methoxy-phenyl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-1-[(2-fluorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-1-(2-fluorobenzyl)sulfonyl-isonipecotamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F

InChI

InChI=1S/C20H22ClFN2O4S/c1-28-19-7-6-16(21)12-18(19)23-20(25)14-8-10-24(11-9-14)29(26,27)13-15-4-2-3-5-17(15)22/h2-7,12,14H,8-11,13H2,1H3,(H,23,25)