2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethylazanium

Systemtic Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethylazanium Openeye Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethylammonium CAS Name: 2-[(4-methoxycarbonylphenyl)methylthio]ethylammonium IUPAC Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethylazanium Traditional Name: 2-[(4-carbomethoxybenzyl)thio]ethylammonium Formula: C11H16NO2S+ MolecularWeight: 226.31524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSCC[NH3+]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSCC[NH3+]

InChI

InChI=1S/C11H15NO2S/c1-14-11(13)10-4-2-9(3-5-10)8-15-7-6-12/h2-5H,6-8,12H2,1H3/p+1