2-oxidanylidene-N-(3-piperidin-1-ium-1-ylpropyl)-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-(3-piperidin-1-ium-1-ylpropyl)-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: 2-oxo-N-(3-piperidin-1-ium-1-ylpropyl)-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: 2-oxo-N-[3-(1-piperidin-1-iumyl)propyl]-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: 2-oxo-N-(3-piperidin-1-ium-1-ylpropyl)-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-(3-piperidin-1-ium-1-ylpropyl)-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C17H26N3O3S+ MolecularWeight: 352.47164

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C17H25N3O3S/c21-17-8-5-14-13-15(6-7-16(14)19-17)24(22,23)18-9-4-12-20-10-2-1-3-11-20/h6-7,13,18H,1-5,8-12H2,(H,19,21)/p+1