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

Systemtic Name: (3S)-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(2-morpholino-5-morpholinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(2-morpholino-5-morpholinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)[C@@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C23H27N3O7S/c27-23(22-16-32-20-3-1-2-4-21(20)33-22)24-18-15-17(34(28,29)26-9-13-31-14-10-26)5-6-19(18)25-7-11-30-12-8-25/h1-6,15,22H,7-14,16H2,(H,24,27)/t22-/m0/s1