7-phenyl-2-(phenylmethyl)sulfonyl-heptanoic acid

Systemtic Name: 7-phenyl-2-(phenylmethyl)sulfonyl-heptanoic acid Openeye Name: 2-benzylsulfonyl-7-phenyl-heptanoic acid CAS Name: 7-phenyl-2-(phenylmethyl)sulfonylheptanoic acid IUPAC Name: 2-benzylsulfonyl-7-phenylheptanoic acid Traditional Name: 2-benzylsulfonyl-7-phenyl-enanthic acid Formula: C20H24O4S MolecularWeight: 360.46716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCC(C(=O)O)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCCC(C(=O)O)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H24O4S/c21-20(22)19(25(23,24)16-18-13-7-2-8-14-18)15-9-3-6-12-17-10-4-1-5-11-17/h1-2,4-5,7-8,10-11,13-14,19H,3,6,9,12,15-16H2,(H,21,22)