3-(azepan-1-ylcarbonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-1H-quinoline-6-sulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-1H-quinoline-6-sulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-1H-quinoline-6-sulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-1H-quinoline-6-sulfonamide Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H25N3O6S/c28-23-18-14-17(34(30,31)26-16-5-8-21-22(13-16)33-12-11-32-21)6-7-20(18)25-15-19(23)24(29)27-9-3-1-2-4-10-27/h5-8,13-15,26H,1-4,9-12H2,(H,25,28)