dimethyl 4-cyano-4-thiophen-2-yl-heptanedioate

Systemtic Name: dimethyl 4-cyano-4-thiophen-2-yl-heptanedioate Openeye Name: dimethyl 4-cyano-4-(2-thienyl)heptanedioate CAS Name: 4-cyano-4-thiophen-2-ylheptanedioic acid dimethyl ester IUPAC Name: dimethyl 4-cyano-4-thiophen-2-ylheptanedioate Traditional Name: 4-cyano-4-(2-thienyl)pimelic acid dimethyl ester Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC(=O)OC)(C#N)C1=CC=CS1

Isomeric SMILES

COC(=O)CCC(CCC(=O)OC)(C#N)C1=CC=CS1

InChI

InChI=1S/C14H17NO4S/c1-18-12(16)5-7-14(10-15,8-6-13(17)19-2)11-4-3-9-20-11/h3-4,9H,5-8H2,1-2H3