N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-chloro-4-isopropoxy-phenyl)-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-chloro-4-isopropoxy-phenyl)-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C21H24ClFN2O4S MolecularWeight: 454.942663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C21H24ClFN2O4S/c1-14(2)29-19-9-7-16(13-17(19)22)24-21(26)15-6-8-18(23)20(12-15)30(27,28)25-10-4-3-5-11-25/h6-9,12-14H,3-5,10-11H2,1-2H3,(H,24,26)