N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(1-pyrrolidinylsulfonyl)-2-furancarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-pyrrolidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-pyrrolidinosulfonyl-2-furamide Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H20N2O6S/c21-18(19-13-4-5-14-16(12-13)25-11-3-10-24-14)15-6-7-17(26-15)27(22,23)20-8-1-2-9-20/h4-7,12H,1-3,8-11H2,(H,19,21)