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

Systemtic Name: 2-[(1S,2R,5R)-2-carboxy-5-propan-2-yl-cyclopentyl]-4-methyl-6-oxidanyl-benzoic acid Openeye Name: 2-[(1S,2R,5R)-2-carboxy-5-isopropyl-cyclopentyl]-6-hydroxy-4-methyl-benzoic acid CAS Name: 2-[(1S,2R,5R)-2-carboxy-5-propan-2-ylcyclopentyl]-6-hydroxy-4-methylbenzoic acid IUPAC Name: 2-[(1S,2R,5R)-2-carboxy-5-propan-2-ylcyclopentyl]-6-hydroxy-4-methylbenzoic acid Traditional Name: 2-[(1S,2R,5R)-2-carboxy-5-isopropyl-cyclopentyl]-6-hydroxy-4-methyl-benzoic acid Formula: C17H22O5 MolecularWeight: 306.35358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(CCC2C(=O)O)C(C)C)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H22O5/c1-8(2)10-4-5-11(16(19)20)14(10)12-6-9(3)7-13(18)15(12)17(21)22/h6-8,10-11,14,18H,4-5H2,1-3H3,(H,19,20)(H,21,22)/t10-,11-,14+/m1/s1