[3-(4-ethoxy-4-oxidanylidene-butyl)sulfanyl-1,1-dimethyl-7-oxidanyl-3,4-dihydro-2H-naphthalen-2-yl]azanium

Systemtic Name: [3-(4-ethoxy-4-oxidanylidene-butyl)sulfanyl-1,1-dimethyl-7-oxidanyl-3,4-dihydro-2H-naphthalen-2-yl]azanium Openeye Name: [3-(4-ethoxy-4-oxo-butyl)sulfanyl-7-hydroxy-1,1-dimethyl-tetralin-2-yl]ammonium CAS Name: [3-[(4-ethoxy-4-oxobutyl)thio]-7-hydroxy-1,1-dimethyl-3,4-dihydro-2H-naphthalen-2-yl]ammonium IUPAC Name: [3-(4-ethoxy-4-oxobutyl)sulfanyl-7-hydroxy-1,1-dimethyl-3,4-dihydro-2H-naphthalen-2-yl]azanium Traditional Name: [3-[(4-ethoxy-4-keto-butyl)thio]-7-hydroxy-1,1-dimethyl-tetralin-2-yl]ammonium Formula: C18H28NO3S+ MolecularWeight: 338.48482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1CC2=C(C=C(C=C2)O)C(C1[NH3+])(C)C

Isomeric SMILES

CCOC(=O)CCCSC1CC2=C(C=C(C=C2)O)C(C1[NH3+])(C)C

InChI

InChI=1S/C18H27NO3S/c1-4-22-16(21)6-5-9-23-15-10-12-7-8-13(20)11-14(12)18(2,3)17(15)19/h7-8,11,15,17,20H,4-6,9-10,19H2,1-3H3/p+1