N-(4-ethoxyphenyl)-4-fluoranyl-3-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-fluoranyl-3-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-benzamide Openeye Name: 3-[(4-benzyl-1-piperidyl)sulfonyl]-N-(4-ethoxyphenyl)-4-fluoro-benzamide CAS Name: N-(4-ethoxyphenyl)-4-fluoro-3-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperidin-1-yl)sulfonyl-N-(4-ethoxyphenyl)-4-fluorobenzamide Traditional Name: 3-(4-benzylpiperidino)sulfonyl-4-fluoro-N-p-phenetyl-benzamide Formula: C27H29FN2O4S MolecularWeight: 496.593563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29FN2O4S/c1-2-34-24-11-9-23(10-12-24)29-27(31)22-8-13-25(28)26(19-22)35(32,33)30-16-14-21(15-17-30)18-20-6-4-3-5-7-20/h3-13,19,21H,2,14-18H2,1H3,(H,29,31)