2-(6-methoxynaphthalen-2-yl)-2-methyl-5-[methyl(diphenyl)azaniumyl]sulfanyl-pentanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-5-[methyl(diphenyl)azaniumyl]sulfanyl-pentanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-methyl-5-[methyl(diphenyl)ammonio]sulfanyl-pentanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-methyl-5-[[methyl(diphenyl)ammonio]thio]pentanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-methyl-5-[methyl(diphenyl)azaniumyl]sulfanylpentanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-methyl-5-[[methyl(diphenyl)ammonio]thio]valerate Formula: C30H31NO3S MolecularWeight: 485.63704

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCS[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(CCCS[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/C30H31NO3S/c1-30(29(32)33,25-17-15-24-22-28(34-3)18-16-23(24)21-25)19-10-20-35-31(2,26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-9,11-18,21-22H,10,19-20H2,1-3H3