2-(6-methoxynaphthalen-2-yl)-2-methyl-6-(trimethylazaniumyl)sulfanyl-hexanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-6-(trimethylazaniumyl)sulfanyl-hexanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-methyl-6-(trimethylammonio)sulfanyl-hexanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-methyl-6-[(trimethylammonio)thio]hexanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-6-(trimethylazaniumyl)sulfanylhexanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-methyl-6-[(trimethylammonio)thio]hexanoate Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO3S/c1-21(20(23)24,12-6-7-13-26-22(2,3)4)18-10-8-17-15-19(25-5)11-9-16(17)14-18/h8-11,14-15H,6-7,12-13H2,1-5H3