2-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-fluoranyl-benzamide Openeye Name: 2-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-6-fluoro-benzamide CAS Name: 2-chloro-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-6-fluorobenzamide IUPAC Name: 2-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-6-fluorobenzamide Traditional Name: 2-chloro-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-6-fluoro-benzamide Formula: C19H20ClFN2O4S MolecularWeight: 426.889503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H20ClFN2O4S/c1-2-27-16-9-8-13(12-17(16)28(25,26)23-10-3-4-11-23)22-19(24)18-14(20)6-5-7-15(18)21/h5-9,12H,2-4,10-11H2,1H3,(H,22,24)