2-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-yl-cyclopentyl]-4-methyl-6-oxidanyl-benzoic acid

Systemtic Name: 2-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-yl-cyclopentyl]-4-methyl-6-oxidanyl-benzoic acid Openeye Name: 2-[(1R,2R,5R)-2-carboxy-5-isopropyl-2-methyl-cyclopentyl]-6-hydroxy-4-methyl-benzoic acid CAS Name: 2-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-ylcyclopentyl]-6-hydroxy-4-methylbenzoic acid IUPAC Name: 2-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-ylcyclopentyl]-6-hydroxy-4-methylbenzoic acid Traditional Name: 2-[(1R,2R,5R)-2-carboxy-5-isopropyl-2-methyl-cyclopentyl]-6-hydroxy-4-methyl-benzoic acid Formula: C18H24O5 MolecularWeight: 320.38016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(CCC2(C)C(=O)O)C(C)C)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H24O5/c1-9(2)11-5-6-18(4,17(22)23)15(11)12-7-10(3)8-13(19)14(12)16(20)21/h7-9,11,15,19H,5-6H2,1-4H3,(H,20,21)(H,22,23)/t11-,15-,18-/m1/s1