1-pyridin-3-ylsulfonyl-1,4-diazepan-4-ium

Systemtic Name: 1-pyridin-3-ylsulfonyl-1,4-diazepan-4-ium Openeye Name: 1-(3-pyridylsulfonyl)-1,4-diazepan-4-ium CAS Name: 1-(3-pyridinylsulfonyl)-1,4-diazepan-4-ium IUPAC Name: 1-pyridin-3-ylsulfonyl-1,4-diazepan-4-ium Traditional Name: 1-(3-pyridylsulfonyl)-1,4-diazepan-4-ium Formula: C10H16N3O2S+ MolecularWeight: 242.31794

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)S(=O)(=O)C2=CN=CC=C2

Isomeric SMILES

C1C[NH2+]CCN(C1)S(=O)(=O)C2=CN=CC=C2

InChI

InChI=1S/C10H15N3O2S/c14-16(15,10-3-1-4-12-9-10)13-7-2-5-11-6-8-13/h1,3-4,9,11H,2,5-8H2/p+1