6-cyano-6-(3-cyanothiophen-2-yl)-7-methyl-octan-3-olate

Systemtic Name: 6-cyano-6-(3-cyanothiophen-2-yl)-7-methyl-octan-3-olate Openeye Name: 6-cyano-6-(3-cyano-2-thienyl)-7-methyl-octan-3-olate CAS Name: 6-cyano-6-(3-cyano-2-thiophenyl)-7-methyl-3-octanolate IUPAC Name: 6-cyano-6-(3-cyanothiophen-2-yl)-7-methyloctan-3-olate Traditional Name: 6-cyano-6-(3-cyano-2-thienyl)-7-methyl-octan-3-olate Formula: C15H19N2OS- MolecularWeight: 275.38916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1=C(C=CS1)C#N)C(C)C)[O-]

Isomeric SMILES

CCC(CCC(C#N)(C1=C(C=CS1)C#N)C(C)C)[O-]

InChI

InChI=1S/C15H19N2OS/c1-4-13(18)5-7-15(10-17,11(2)3)14-12(9-16)6-8-19-14/h6,8,11,13H,4-5,7H2,1-3H3/q-1