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2-azaniumylethylsulfonyl-(3-butoxyphenyl)azanide

2-azaniumylethylsulfonyl-(3-butoxyphenyl)azanide

Systemtic Name:2-azaniumylethylsulfonyl-(3-butoxyphenyl)azanide
Openeye Name:2-azaniumylethylsulfonyl-(3-butoxyphenyl)azanide
CAS Name:2-ammonioethylsulfonyl-(3-butoxyphenyl)azanide
IUPAC Name:2-azaniumylethylsulfonyl-(3-butoxyphenyl)azanide
Traditional Name:2-ammonioethylsulfonyl-(3-butoxyphenyl)azanide
Formula: C12H20N2O3S
MolecularWeight: 272.3638
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)[N-]S(=O)(=O)CC[NH3+]


Isomeric SMILES

CCCCOC1=CC=CC(=C1)[N-]S(=O)(=O)CC[NH3+]


InChI

InChI=1S/C12H19N2O3S/c1-2-3-8-17-12-6-4-5-11(10-12)14-18(15,16)9-7-13/h4-6,10H,2-3,7-9,13H2,1H3/q-1/p+1


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