2-(6-methoxynaphthalen-2-yl)-2-methyl-7-[methyl(diphenyl)azaniumyl]sulfanyl-heptanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-7-[methyl(diphenyl)azaniumyl]sulfanyl-heptanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-methyl-7-[methyl(diphenyl)ammonio]sulfanyl-heptanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-methyl-7-[[methyl(diphenyl)ammonio]thio]heptanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-7-[methyl(diphenyl)azaniumyl]sulfanylheptanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-methyl-7-[[methyl(diphenyl)ammonio]thio]enanthate Formula: C32H35NO3S MolecularWeight: 513.6902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCS[N+](C)(C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC4=C(C=C3)C=C(C=C4)OC)C(=O)[O-]

Isomeric SMILES

CC(CCCCCS[N+](C)(C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC4=C(C=C3)C=C(C=C4)OC)C(=O)[O-]

InChI

InChI=1S/C32H35NO3S/c1-32(31(34)35,27-19-17-26-24-30(36-3)20-18-25(26)23-27)21-11-6-12-22-37-33(2,28-13-7-4-8-14-28)29-15-9-5-10-16-29/h4-5,7-10,13-20,23-24H,6,11-12,21-22H2,1-3H3