3-chloranylsulfonyl-4-(phenylcarbonyl)-5-prop-2-ynoxy-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-(phenylcarbonyl)-5-prop-2-ynoxy-benzoic acid Openeye Name: 4-benzoyl-3-chlorosulfonyl-5-prop-2-ynoxy-benzoic acid CAS Name: 4-benzoyl-3-chlorosulfonyl-5-prop-2-ynoxybenzoic acid IUPAC Name: 4-benzoyl-3-chlorosulfonyl-5-prop-2-ynoxybenzoic acid Traditional Name: 4-benzoyl-3-chlorosulfonyl-5-propargyloxy-benzoic acid Formula: C17H11ClO6S MolecularWeight: 378.78364

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

C#CCOC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H11ClO6S/c1-2-8-24-13-9-12(17(20)21)10-14(25(18,22)23)15(13)16(19)11-6-4-3-5-7-11/h1,3-7,9-10H,8H2,(H,20,21)