2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylazanium

Systemtic Name: 2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylazanium Openeye Name: 2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylammonium CAS Name: 2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylammonium IUPAC Name: 2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylazanium Traditional Name: 2-[2-(2,4,5-trimethylphenoxy)ethylsulfonyl]ethylammonium Formula: C13H22NO3S+ MolecularWeight: 272.38368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OCCS(=O)(=O)CC[NH3+])C

Isomeric SMILES

CC1=CC(=C(C=C1C)OCCS(=O)(=O)CC[NH3+])C

InChI

InChI=1S/C13H21NO3S/c1-10-8-12(3)13(9-11(10)2)17-5-7-18(15,16)6-4-14/h8-9H,4-7,14H2,1-3H3/p+1