[(3R)-4-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfanyl]-3-oxidanyl-butyl]azanium

Systemtic Name: [(3R)-4-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfanyl]-3-oxidanyl-butyl]azanium Openeye Name: [(3R)-4-(1-acetylindolin-5-yl)sulfanyl-3-hydroxy-butyl]ammonium CAS Name: [(3R)-4-[(1-acetyl-2,3-dihydroindol-5-yl)thio]-3-hydroxybutyl]ammonium IUPAC Name: [(3R)-4-[(1-acetyl-2,3-dihydroindol-5-yl)sulfanyl]-3-hydroxybutyl]azanium Traditional Name: [(3R)-4-[(1-acetylindolin-5-yl)thio]-3-hydroxy-butyl]ammonium Formula: C14H21N2O2S+ MolecularWeight: 281.39374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)SCC(CC[NH3+])O

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)SC[C@@H](CC[NH3+])O

InChI

InChI=1S/C14H20N2O2S/c1-10(17)16-7-5-11-8-13(2-3-14(11)16)19-9-12(18)4-6-15/h2-3,8,12,18H,4-7,9,15H2,1H3/p+1/t12-/m1/s1