dimethyl 3-stannaspiro[2.2]pentane-2,5-dicarboxylate; 2-sulfanylicosanoic acid

Systemtic Name: dimethyl 3-stannaspiro[2.2]pentane-2,5-dicarboxylate; 2-sulfanylicosanoic acid Openeye Name: dimethyl 3-stannaspiro[2.2]pentane-2,5-dicarboxylate; 2-sulfanylicosanoic acid CAS Name: 2-mercaptoeicosanoic acid; 3-stannaspiro[2.2]pentane-2,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-stannaspiro[2.2]pentane-2,5-dicarboxylate; 2-sulfanylicosanoic acid Traditional Name: 2-mercaptoarachidic acid; 3-stannaspiro[2.2]pentane-2,5-dicarboxylic acid dimethyl ester Formula: C48H92O8S2Sn MolecularWeight: 980.07928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(=O)O)S.CCCCCCCCCCCCCCCCCCC(C(=O)O)S.COC(=O)C1C[Sn]12CC2C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C(=O)O)S.CCCCCCCCCCCCCCCCCCC(C(=O)O)S.COC(=O)C1C[Sn]12CC2C(=O)OC

InChI

InChI=1S/2C20H40O2S.2C4H6O2.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(23)20(21)22;2*1-3-4(5)6-2;/h2*19,23H,2-18H2,1H3,(H,21,22);2*3H,1H2,2H3;