3-[6-chloranyl-2-cyclohexylcarbonyl-1-(2-ethylbutanoyloxy)indol-3-yl]oxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[6-chloranyl-2-cyclohexylcarbonyl-1-(2-ethylbutanoyloxy)indol-3-yl]oxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[6-chloro-2-(cyclohexanecarbonyl)-1-(2-ethylbutanoyloxy)indol-3-yl]oxy-3-oxo-propanoic acid CAS Name: 3-[[6-chloro-2-[cyclohexyl(oxo)methyl]-1-(2-ethyl-1-oxobutoxy)-3-indolyl]oxy]-3-oxopropanoic acid IUPAC Name: 3-[6-chloro-2-(cyclohexanecarbonyl)-1-(2-ethylbutanoyloxy)indol-3-yl]oxy-3-oxopropanoic acid Traditional Name: 3-[6-chloro-2-(cyclohexanecarbonyl)-1-(2-ethylbutanoyloxy)indol-3-yl]oxy-3-keto-propionic acid Formula: C24H28ClNO7 MolecularWeight: 477.93462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)ON1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3CCCCC3)OC(=O)CC(=O)O

Isomeric SMILES

CCC(CC)C(=O)ON1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3CCCCC3)OC(=O)CC(=O)O

InChI

InChI=1S/C24H28ClNO7/c1-3-14(4-2)24(31)33-26-18-12-16(25)10-11-17(18)23(32-20(29)13-19(27)28)21(26)22(30)15-8-6-5-7-9-15/h10-12,14-15H,3-9,13H2,1-2H3,(H,27,28)