methyl 2-isocyano-2-thiophen-2-yl-butanoate

Systemtic Name: methyl 2-isocyano-2-thiophen-2-yl-butanoate Openeye Name: methyl 2-isocyano-2-(2-thienyl)butanoate CAS Name: 2-isocyano-2-thiophen-2-ylbutanoic acid methyl ester IUPAC Name: methyl 2-isocyano-2-thiophen-2-ylbutanoate Traditional Name: 2-isocyano-2-(2-thienyl)butyric acid methyl ester Formula: C10H11NO2S MolecularWeight: 209.26484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO2S/c1-4-10(11-2,9(12)13-3)8-6-5-7-14-8/h5-7H,4H2,1,3H3