3-piperazin-4-ium-1-ylsulfonyl-N-quinolin-8-yl-propanamide

Systemtic Name: 3-piperazin-4-ium-1-ylsulfonyl-N-quinolin-8-yl-propanamide Openeye Name: 3-piperazin-4-ium-1-ylsulfonyl-N-(8-quinolyl)propanamide CAS Name: 3-(1-piperazin-4-iumylsulfonyl)-N-(8-quinolinyl)propanamide IUPAC Name: 3-piperazin-4-ium-1-ylsulfonyl-N-quinolin-8-ylpropanamide Traditional Name: 3-piperazin-4-ium-1-ylsulfonyl-N-(8-quinolyl)propionamide Formula: C16H21N4O3S+ MolecularWeight: 349.42794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C16H20N4O3S/c21-15(6-12-24(22,23)20-10-8-17-9-11-20)19-14-5-1-3-13-4-2-7-18-16(13)14/h1-5,7,17H,6,8-12H2,(H,19,21)/p+1