2-chloranyl-4-methylsulfonyl-3-[(E)-2-phenylethenyl]benzoic acid

Systemtic Name: 2-chloranyl-4-methylsulfonyl-3-[(E)-2-phenylethenyl]benzoic acid Openeye Name: 2-chloro-4-methylsulfonyl-3-[(E)-styryl]benzoic acid CAS Name: 2-chloro-4-methylsulfonyl-3-[(E)-2-phenylethenyl]benzoic acid IUPAC Name: 2-chloro-4-methylsulfonyl-3-[(E)-2-phenylethenyl]benzoic acid Traditional Name: 2-chloro-4-mesyl-3-[(E)-styryl]benzoic acid Formula: C16H13ClO4S MolecularWeight: 336.79002

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)O)Cl)C=CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)O)Cl)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H13ClO4S/c1-22(20,21)14-10-9-13(16(18)19)15(17)12(14)8-7-11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)/b8-7+