(2-aminophenyl)-(azepan-1-ium-1-ylsulfonyl)azanide

Systemtic Name: (2-aminophenyl)-(azepan-1-ium-1-ylsulfonyl)azanide Openeye Name: (2-aminophenyl)-(azepan-1-ium-1-ylsulfonyl)azanide CAS Name: (2-aminophenyl)-(1-azepan-1-iumylsulfonyl)azanide IUPAC Name: (2-aminophenyl)-(azepan-1-ium-1-ylsulfonyl)azanide Traditional Name: (2-aminophenyl)-(azepan-1-ium-1-ylsulfonyl)azanide Formula: C12H19N3O2S MolecularWeight: 269.36316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)S(=O)(=O)[N-]C2=CC=CC=C2N

Isomeric SMILES

C1CCC[NH+](CC1)S(=O)(=O)[N-]C2=CC=CC=C2N

InChI

InChI=1S/C12H18N3O2S/c13-11-7-3-4-8-12(11)14-18(16,17)15-9-5-1-2-6-10-15/h3-4,7-8H,1-2,5-6,9-10,13H2/q-1/p+1