(2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H21FN2O5S/c21-15-5-1-2-7-19(15)29(25,26)23-10-3-6-16(23)20(24)22-14-8-9-17-18(13-14)28-12-4-11-27-17/h1-2,5,7-9,13,16H,3-4,6,10-12H2,(H,22,24)/t16-/m0/s1