N-[(4-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 4-benzyl-N-[(4-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-benzyl-N-[(4-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 4-benzyl-N-(4-fluorobenzyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C27H29FN2O4S MolecularWeight: 496.593563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(CC3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(CC3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F

InChI

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