N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxamide Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)sulfonyl-4-phenyl-piperidine-4-carboxamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)sulfonyl-4-phenyl-4-piperidinecarboxamide IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)sulfonyl-4-phenylpiperidine-4-carboxamide Traditional Name: N-(2,4-dimethoxybenzyl)-1-(3-fluorophenyl)sulfonyl-4-phenyl-isonipecotamide Formula: C27H29FN2O5S MolecularWeight: 512.592963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2(CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2(CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H29FN2O5S/c1-34-23-12-11-20(25(18-23)35-2)19-29-26(31)27(21-7-4-3-5-8-21)13-15-30(16-14-27)36(32,33)24-10-6-9-22(28)17-24/h3-12,17-18H,13-16,19H2,1-2H3,(H,29,31)