(3S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)[C@@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C23H27N3O6S/c27-23(22-16-31-20-5-1-2-6-21(20)32-22)24-18-15-17(7-8-19(18)25-9-3-4-10-25)33(28,29)26-11-13-30-14-12-26/h1-2,5-8,15,22H,3-4,9-14,16H2,(H,24,27)/t22-/m0/s1