3-[(1S,2S,5R)-1-methyl-2-(3-methylphenyl)-5-propan-2-yl-cyclopentyl]propanoic acid

Systemtic Name: 3-[(1S,2S,5R)-1-methyl-2-(3-methylphenyl)-5-propan-2-yl-cyclopentyl]propanoic acid Openeye Name: 3-[(1S,2R,5S)-2-isopropyl-1-methyl-5-(m-tolyl)cyclopentyl]propanoic acid CAS Name: 3-[(1S,2S,5R)-1-methyl-2-(3-methylphenyl)-5-propan-2-ylcyclopentyl]propanoic acid IUPAC Name: 3-[(1S,2S,5R)-1-methyl-2-(3-methylphenyl)-5-propan-2-ylcyclopentyl]propanoic acid Traditional Name: 3-[(1S,2R,5S)-2-isopropyl-1-methyl-5-(m-tolyl)cyclopentyl]propionic acid Formula: C19H28O2 MolecularWeight: 288.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCC(C2(C)CCC(=O)O)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2CC[C@@H]([C@]2(C)CCC(=O)O)C(C)C

InChI

InChI=1S/C19H28O2/c1-13(2)16-8-9-17(15-7-5-6-14(3)12-15)19(16,4)11-10-18(20)21/h5-7,12-13,16-17H,8-11H2,1-4H3,(H,20,21)/t16-,17-,19+/m1/s1