2-(3-isocyanatothiophen-2-yl)ethanoic acid

Systemtic Name: 2-(3-isocyanatothiophen-2-yl)ethanoic acid Openeye Name: 2-(3-isocyanato-2-thienyl)acetic acid CAS Name: 2-(3-isocyanato-2-thiophenyl)acetic acid IUPAC Name: 2-(3-isocyanatothiophen-2-yl)acetic acid Traditional Name: 2-(3-isocyanato-2-thienyl)acetic acid Formula: C7H5NO3S MolecularWeight: 183.1845

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1N=C=O)CC(=O)O

Isomeric SMILES

C1=CSC(=C1N=C=O)CC(=O)O

InChI

InChI=1S/C7H5NO3S/c9-4-8-5-1-2-12-6(5)3-7(10)11/h1-2H,3H2,(H,10,11)