2-prop-2-ynylsulfanylbenzoic acid

Systemtic Name: 2-prop-2-ynylsulfanylbenzoic acid Openeye Name: 2-prop-2-ynylsulfanylbenzoic acid CAS Name: 2-(prop-2-ynylthio)benzoic acid IUPAC Name: 2-prop-2-ynylsulfanylbenzoic acid Traditional Name: 2-(propargylthio)benzoic acid Formula: C10H8O2S MolecularWeight: 192.23432

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=CC=CC=C1C(=O)O

Isomeric SMILES

C#CCSC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C10H8O2S/c1-2-7-13-9-6-4-3-5-8(9)10(11)12/h1,3-6H,7H2,(H,11,12)