(1-ethoxycarbonylpiperidin-4-yl)-(3-methylsulfanylpropyl)azanium

Systemtic Name: (1-ethoxycarbonylpiperidin-4-yl)-(3-methylsulfanylpropyl)azanium Openeye Name: (1-ethoxycarbonyl-4-piperidyl)-(3-methylsulfanylpropyl)ammonium CAS Name: (1-ethoxycarbonyl-4-piperidinyl)-[3-(methylthio)propyl]ammonium IUPAC Name: (1-ethoxycarbonylpiperidin-4-yl)-(3-methylsulfanylpropyl)azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[3-(methylthio)propyl]ammonium Formula: C12H25N2O2S+ MolecularWeight: 261.4041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]CCCSC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]CCCSC

InChI

InChI=1S/C12H24N2O2S/c1-3-16-12(15)14-8-5-11(6-9-14)13-7-4-10-17-2/h11,13H,3-10H2,1-2H3/p+1