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

Systemtic Name: 3-bromanyl-6-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-yl-cyclopentyl]-4-methyl-2-oxidanyl-benzoic acid Openeye Name: 3-bromo-6-[(1R,2R,5R)-2-carboxy-5-isopropyl-2-methyl-cyclopentyl]-2-hydroxy-4-methyl-benzoic acid CAS Name: 3-bromo-6-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-ylcyclopentyl]-2-hydroxy-4-methylbenzoic acid IUPAC Name: 3-bromo-6-[(1R,2R,5R)-2-carboxy-2-methyl-5-propan-2-ylcyclopentyl]-2-hydroxy-4-methylbenzoic acid Traditional Name: 3-bromo-6-[(1R,2R,5R)-2-carboxy-5-isopropyl-2-methyl-cyclopentyl]-2-hydroxy-4-methyl-benzoic acid Formula: C18H23BrO5 MolecularWeight: 399.27622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrO5/c1-8(2)10-5-6-18(4,17(23)24)13(10)11-7-9(3)14(19)15(20)12(11)16(21)22/h7-8,10,13,20H,5-6H2,1-4H3,(H,21,22)(H,23,24)/t10-,13-,18-/m1/s1