4-chloranyl-3-prop-2-ynylsulfonyl-benzoic acid

Systemtic Name: 4-chloranyl-3-prop-2-ynylsulfonyl-benzoic acid Openeye Name: 4-chloro-3-prop-2-ynylsulfonyl-benzoic acid CAS Name: 4-chloro-3-prop-2-ynylsulfonylbenzoic acid IUPAC Name: 4-chloro-3-prop-2-ynylsulfonylbenzoic acid Traditional Name: 4-chloro-3-propargylsulfonyl-benzoic acid Formula: C10H7ClO4S MolecularWeight: 258.67818

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Descriptors Computed from Structure

Canonical SMILES:

C#CCS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Cl

Isomeric SMILES

C#CCS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C10H7ClO4S/c1-2-5-16(14,15)9-6-7(10(12)13)3-4-8(9)11/h1,3-4,6H,5H2,(H,12,13)