1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide Openeye Name: 1-(5-fluoro-2-methoxy-phenyl)sulfonyl-N-isopentyl-piperidine-3-carboxamide CAS Name: 1-(5-fluoro-2-methoxyphenyl)sulfonyl-N-(3-methylbutyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-fluoro-2-methoxyphenyl)sulfonyl-N-(3-methylbutyl)piperidine-3-carboxamide Traditional Name: 1-(5-fluoro-2-methoxy-phenyl)sulfonyl-N-isoamyl-nipecotamide Formula: C18H27FN2O4S MolecularWeight: 386.481383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CC(C)CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C18H27FN2O4S/c1-13(2)8-9-20-18(22)14-5-4-10-21(12-14)26(23,24)17-11-15(19)6-7-16(17)25-3/h6-7,11,13-14H,4-5,8-10,12H2,1-3H3,(H,20,22)