4-(azepan-1-ylcarbonyl)-N,N-diethyl-2-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N,N-diethyl-2-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N,N-diethyl-2-oxo-1H-quinoline-6-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N,N-diethyl-2-oxo-1H-quinoline-6-sulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N,N-diethyl-2-oxo-1H-quinoline-6-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N,N-diethyl-2-keto-1H-quinoline-6-sulfonamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O4S/c1-3-23(4-2)28(26,27)15-9-10-18-16(13-15)17(14-19(24)21-18)20(25)22-11-7-5-6-8-12-22/h9-10,13-14H,3-8,11-12H2,1-2H3,(H,21,24)