1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-4-ium

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-4-ium Openeye Name: 1-indan-5-ylsulfonyl-1,4-diazepan-4-ium CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-4-ium IUPAC Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1,4-diazepan-4-ium Traditional Name: 1-indan-5-ylsulfonyl-1,4-diazepan-4-ium Formula: C14H21N2O2S+ MolecularWeight: 281.39374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC[NH2+]CC3

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC[NH2+]CC3

InChI

InChI=1S/C14H20N2O2S/c17-19(18,16-9-2-7-15-8-10-16)14-6-5-12-3-1-4-13(12)11-14/h5-6,11,15H,1-4,7-10H2/p+1