1-(3,4-dihydro-2H-quinolin-1-yl)-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-(1-piperazin-4-iumylsulfonyl)-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-piperazin-4-ium-1-ylsulfonylpropan-1-one Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Formula: C16H24N3O3S+ MolecularWeight: 338.44506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CCS(=O)(=O)N3CC[NH2+]CC3

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CCS(=O)(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C16H23N3O3S/c20-16(7-13-23(21,22)18-11-8-17-9-12-18)19-10-3-5-14-4-1-2-6-15(14)19/h1-2,4,6,17H,3,5,7-13H2/p+1