4-chloranyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(3-fluoro-4-methoxy-benzyl)-N-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H22ClFN2O4S/c1-23(13-14-5-8-18(28-2)17(22)11-14)20(25)15-6-7-16(21)19(12-15)29(26,27)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10,13H2,1-2H3