3-(1,3-benzothiazol-2-yl)prop-2-ynoic acid

Systemtic Name: 3-(1,3-benzothiazol-2-yl)prop-2-ynoic acid Openeye Name: 3-(1,3-benzothiazol-2-yl)prop-2-ynoic acid CAS Name: 3-(1,3-benzothiazol-2-yl)-2-propynoic acid IUPAC Name: 3-(1,3-benzothiazol-2-yl)prop-2-ynoic acid Traditional Name: 3-(1,3-benzothiazol-2-yl)propiolic acid Formula: C10H5NO2S MolecularWeight: 203.2172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C#CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C#CC(=O)O

InChI

InChI=1S/C10H5NO2S/c12-10(13)6-5-9-11-7-3-1-2-4-8(7)14-9/h1-4H,(H,12,13)