5-[2-ethyl-2,4,4-trimethyl-5-oxidanylidene-5-(5-oxidanylnaphthalen-1-yl)oxy-pentanoyl]oxy-4-(thiolan-1-ium-1-yl)naphthalen-1-olate

Systemtic Name: 5-[2-ethyl-2,4,4-trimethyl-5-oxidanylidene-5-(5-oxidanylnaphthalen-1-yl)oxy-pentanoyl]oxy-4-(thiolan-1-ium-1-yl)naphthalen-1-olate Openeye Name: 5-[2-ethyl-5-[(5-hydroxy-1-naphthyl)oxy]-2,4,4-trimethyl-5-oxo-pentanoyl]oxy-4-tetrahydrothiophen-1-ium-1-yl-naphthalen-1-olate CAS Name: 5-[2-ethyl-5-[(5-hydroxy-1-naphthalenyl)oxy]-2,4,4-trimethyl-1,5-dioxopentoxy]-4-(1-thiolan-1-iumyl)-1-naphthalenolate IUPAC Name: 5-[2-ethyl-5-(5-hydroxynaphthalen-1-yl)oxy-2,4,4-trimethyl-5-oxopentanoyl]oxy-4-(thiolan-1-ium-1-yl)naphthalen-1-olate Traditional Name: 5-[2-ethyl-5-(5-hydroxy-1-naphthoxy)-5-keto-2,4,4-trimethyl-pentanoyl]oxy-4-tetrahydrothiophen-1-ium-1-yl-naphthalen-1-olate Formula: C34H36O6S MolecularWeight: 572.71104

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OC1=CC=CC2=C1C=CC=C2O)C(=O)OC3=CC=CC4=C(C=CC(=C43)[S+]5CCCC5)[O-]

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OC1=CC=CC2=C1C=CC=C2O)C(=O)OC3=CC=CC4=C(C=CC(=C43)[S+]5CCCC5)[O-]

InChI

InChI=1S/C34H36O6S/c1-5-34(4,21-33(2,3)31(37)39-27-15-9-11-22-23(27)12-8-14-25(22)35)32(38)40-28-16-10-13-24-26(36)17-18-29(30(24)28)41-19-6-7-20-41/h8-18H,5-7,19-21H2,1-4H3,(H-,35,36)