[1,1-dimethyl-7-oxidanyl-3-(2-phenoxyethylsulfanyl)-3,4-dihydro-2H-naphthalen-2-yl]azanium

Systemtic Name: [1,1-dimethyl-7-oxidanyl-3-(2-phenoxyethylsulfanyl)-3,4-dihydro-2H-naphthalen-2-yl]azanium Openeye Name: [7-hydroxy-1,1-dimethyl-3-(2-phenoxyethylsulfanyl)tetralin-2-yl]ammonium CAS Name: [7-hydroxy-1,1-dimethyl-3-(2-phenoxyethylthio)-3,4-dihydro-2H-naphthalen-2-yl]ammonium IUPAC Name: [7-hydroxy-1,1-dimethyl-3-(2-phenoxyethylsulfanyl)-3,4-dihydro-2H-naphthalen-2-yl]azanium Traditional Name: [7-hydroxy-1,1-dimethyl-3-(2-phenoxyethylthio)tetralin-2-yl]ammonium Formula: C20H26NO2S+ MolecularWeight: 344.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(CC2=C1C=C(C=C2)O)SCCOC3=CC=CC=C3)[NH3+])C

Isomeric SMILES

CC1(C(C(CC2=C1C=C(C=C2)O)SCCOC3=CC=CC=C3)[NH3+])C

InChI

InChI=1S/C20H25NO2S/c1-20(2)17-13-15(22)9-8-14(17)12-18(19(20)21)24-11-10-23-16-6-4-3-5-7-16/h3-9,13,18-19,22H,10-12,21H2,1-2H3/p+1