3-methyl-8-piperazin-4-ium-1-ylsulfonyl-quinoline

Systemtic Name: 3-methyl-8-piperazin-4-ium-1-ylsulfonyl-quinoline Openeye Name: 3-methyl-8-piperazin-4-ium-1-ylsulfonyl-quinoline CAS Name: 3-methyl-8-(1-piperazin-4-iumylsulfonyl)quinoline IUPAC Name: 3-methyl-8-piperazin-4-ium-1-ylsulfonylquinoline Traditional Name: 3-methyl-8-piperazin-4-ium-1-ylsulfonyl-quinoline Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C14H17N3O2S/c1-11-9-12-3-2-4-13(14(12)16-10-11)20(18,19)17-7-5-15-6-8-17/h2-4,9-10,15H,5-8H2,1H3/p+1