2-(6-methoxynaphthalen-2-yl)-2-methyl-8-(trimethylazaniumyl)sulfanyl-octanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-8-(trimethylazaniumyl)sulfanyl-octanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-methyl-8-(trimethylammonio)sulfanyl-octanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-methyl-8-[(trimethylammonio)thio]octanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-8-(trimethylazaniumyl)sulfanyloctanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-methyl-8-[(trimethylammonio)thio]caprylate Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCS[N+](C)(C)C)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-]

Isomeric SMILES

CC(CCCCCCS[N+](C)(C)C)(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-]

InChI

InChI=1S/C23H33NO3S/c1-23(22(25)26,14-8-6-7-9-15-28-24(2,3)4)20-12-10-19-17-21(27-5)13-11-18(19)16-20/h10-13,16-17H,6-9,14-15H2,1-5H3