3-(3-methoxycyclopentyl)-2-(2-methylsulfonylphenyl)propanoic acid

Systemtic Name: 3-(3-methoxycyclopentyl)-2-(2-methylsulfonylphenyl)propanoic acid Openeye Name: 3-(3-methoxycyclopentyl)-2-(2-methylsulfonylphenyl)propanoic acid CAS Name: 3-(3-methoxycyclopentyl)-2-(2-methylsulfonylphenyl)propanoic acid IUPAC Name: 3-(3-methoxycyclopentyl)-2-(2-methylsulfonylphenyl)propanoic acid Traditional Name: 2-(2-mesylphenyl)-3-(3-methoxycyclopentyl)propionic acid Formula: C16H22O5S MolecularWeight: 326.40788

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(C1)CC(C2=CC=CC=C2S(=O)(=O)C)C(=O)O

Isomeric SMILES

COC1CCC(C1)CC(C2=CC=CC=C2S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C16H22O5S/c1-21-12-8-7-11(9-12)10-14(16(17)18)13-5-3-4-6-15(13)22(2,19)20/h3-6,11-12,14H,7-10H2,1-2H3,(H,17,18)