3-(4-chlorophenyl)-2-prop-2-ynoxy-benzenesulfonic acid

Systemtic Name: 3-(4-chlorophenyl)-2-prop-2-ynoxy-benzenesulfonic acid Openeye Name: 3-(4-chlorophenyl)-2-prop-2-ynoxy-benzenesulfonic acid CAS Name: 3-(4-chlorophenyl)-2-prop-2-ynoxybenzenesulfonic acid IUPAC Name: 3-(4-chlorophenyl)-2-prop-2-ynoxybenzenesulfonic acid Traditional Name: 3-(4-chlorophenyl)-2-propargyloxy-besylic acid Formula: C15H11ClO4S MolecularWeight: 322.76344

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=CC=C1S(=O)(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C#CCOC1=C(C=CC=C1S(=O)(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H11ClO4S/c1-2-10-20-15-13(11-6-8-12(16)9-7-11)4-3-5-14(15)21(17,18)19/h1,3-9H,10H2,(H,17,18,19)