5-[2,4-bis(2-methylpropoxy)phenyl]carbonyl-1-(2-methylpropyl)indole-2-carboxylic acid

Systemtic Name: 5-[2,4-bis(2-methylpropoxy)phenyl]carbonyl-1-(2-methylpropyl)indole-2-carboxylic acid Openeye Name: 5-(2,4-diisobutoxybenzoyl)-1-isobutyl-indole-2-carboxylic acid CAS Name: 5-[[2,4-bis(2-methylpropoxy)phenyl]-oxomethyl]-1-(2-methylpropyl)-2-indolecarboxylic acid IUPAC Name: 5-[2,4-bis(2-methylpropoxy)benzoyl]-1-(2-methylpropyl)indole-2-carboxylic acid Traditional Name: 5-(2,4-diisobutoxybenzoyl)-1-isobutyl-indole-2-carboxylic acid Formula: C28H35NO5 MolecularWeight: 465.5812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)C(=O)C3=C(C=C(C=C3)OCC(C)C)OCC(C)C)C=C1C(=O)O

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)C(=O)C3=C(C=C(C=C3)OCC(C)C)OCC(C)C)C=C1C(=O)O

InChI

InChI=1S/C28H35NO5/c1-17(2)14-29-24-10-7-20(11-21(24)12-25(29)28(31)32)27(30)23-9-8-22(33-15-18(3)4)13-26(23)34-16-19(5)6/h7-13,17-19H,14-16H2,1-6H3,(H,31,32)