1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N,N-bis(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N,N-bis(phenylmethyl)piperidine-3-carboxamide Openeye Name: N,N-dibenzyl-1-(5-fluoro-2-methoxy-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-(5-fluoro-2-methoxyphenyl)sulfonyl-N,N-bis(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N,N-dibenzyl-1-(5-fluoro-2-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N,N-dibenzyl-1-(5-fluoro-2-methoxy-phenyl)sulfonyl-nipecotamide Formula: C27H29FN2O4S MolecularWeight: 496.593563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCC(C2)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCC(C2)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29FN2O4S/c1-34-25-15-14-24(28)17-26(25)35(32,33)30-16-8-13-23(20-30)27(31)29(18-21-9-4-2-5-10-21)19-22-11-6-3-7-12-22/h2-7,9-12,14-15,17,23H,8,13,16,18-20H2,1H3