[(2R)-3-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfanyl]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2R)-3-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfanyl]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfanyl]-2-hydroxy-propyl]ammonium CAS Name: [(2R)-3-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)thio]-2-hydroxypropyl]ammonium IUPAC Name: [(2R)-3-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfanyl]-2-hydroxypropyl]azanium Traditional Name: [(2R)-3-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)thio]-2-hydroxy-propyl]ammonium Formula: C14H21N2O2S+ MolecularWeight: 281.39374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)SCC(C[NH3+])O

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)SC[C@@H](C[NH3+])O

InChI

InChI=1S/C14H20N2O2S/c1-10(17)16-6-2-3-11-7-13(4-5-14(11)16)19-9-12(18)8-15/h4-5,7,12,18H,2-3,6,8-9,15H2,1H3/p+1/t12-/m1/s1