4-cyano-2-[2,2-dimethyl-3-[3-(2-methylprop-2-enoyloxy)-2-oxidanyl-propoxy]-3-oxidanylidene-propyl]-6-ethoxycarbonyl-8-methoxycarbonyl-2,8-dimethyl-decanoic acid

Systemtic Name: 4-cyano-2-[2,2-dimethyl-3-[3-(2-methylprop-2-enoyloxy)-2-oxidanyl-propoxy]-3-oxidanylidene-propyl]-6-ethoxycarbonyl-8-methoxycarbonyl-2,8-dimethyl-decanoic acid Openeye Name: 4-cyano-6-ethoxycarbonyl-2-[3-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,2-dimethyl-3-oxo-propyl]-8-methoxycarbonyl-2,8-dimethyl-decanoic acid CAS Name: 4-cyano-6-ethoxycarbonyl-2-[3-[2-hydroxy-3-(2-methyl-1-oxoprop-2-enoxy)propoxy]-2,2-dimethyl-3-oxopropyl]-8-methoxycarbonyl-2,8-dimethyldecanoic acid IUPAC Name: 4-cyano-6-ethoxycarbonyl-2-[3-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,2-dimethyl-3-oxopropyl]-8-methoxycarbonyl-2,8-dimethyldecanoic acid Traditional Name: 6-carbethoxy-8-carbomethoxy-4-cyano-2-[3-(2-hydroxy-3-methacryloyloxy-propoxy)-3-keto-2,2-dimethyl-propyl]-2,8-dimethyl-capric acid Formula: C30H47NO11 MolecularWeight: 597.69428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(CC(CC(C)(CC(C)(C)C(=O)OCC(COC(=O)C(=C)C)O)C(=O)O)C#N)C(=O)OCC)C(=O)OC

Isomeric SMILES

CCC(C)(CC(CC(CC(C)(CC(C)(C)C(=O)OCC(COC(=O)C(=C)C)O)C(=O)O)C#N)C(=O)OCC)C(=O)OC

InChI

InChI=1S/C30H47NO11/c1-10-29(7,27(38)39-9)14-21(24(34)40-11-2)12-20(15-31)13-30(8,25(35)36)18-28(5,6)26(37)42-17-22(32)16-41-23(33)19(3)4/h20-22,32H,3,10-14,16-18H2,1-2,4-9H3,(H,35,36)