dibutyl-[7-(6-methoxynaphthalen-2-yl)-7-methyl-8-oxidanyl-8-oxidanylidene-octyl]sulfanyl-methyl-azanium

Systemtic Name: dibutyl-[7-(6-methoxynaphthalen-2-yl)-7-methyl-8-oxidanyl-8-oxidanylidene-octyl]sulfanyl-methyl-azanium Openeye Name: dibutyl-[8-hydroxy-7-(6-methoxy-2-naphthyl)-7-methyl-8-oxo-octyl]sulfanyl-methyl-ammonium CAS Name: dibutyl-[[8-hydroxy-7-(6-methoxy-2-naphthalenyl)-7-methyl-8-oxooctyl]thio]-methylammonium IUPAC Name: dibutyl-[8-hydroxy-7-(6-methoxynaphthalen-2-yl)-7-methyl-8-oxooctyl]sulfanyl-methylazanium Traditional Name: dibutyl-[[8-hydroxy-8-keto-7-(6-methoxy-2-naphthyl)-7-methyl-octyl]thio]-methyl-ammonium Formula: C29H46NO3S+ MolecularWeight: 488.74544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(CCCC)SCCCCCCC(C)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O

Isomeric SMILES

CCCC[N+](C)(CCCC)SCCCCCCC(C)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C29H45NO3S/c1-6-8-19-30(4,20-9-7-2)34-21-13-11-10-12-18-29(3,28(31)32)26-16-14-25-23-27(33-5)17-15-24(25)22-26/h14-17,22-23H,6-13,18-21H2,1-5H3/p+1