2-[1-[4-(3,7-dimethyloct-6-enoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(3,7-dimethyloct-6-enoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(3,7-dimethyloct-6-enoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[[4-(3,7-dimethyloct-6-enoxy)phenyl]-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-[4-(3,7-dimethyloct-6-enoxy)benzoyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-[4-(3,7-dimethyloct-6-enoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C28H33NO4 MolecularWeight: 447.56592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC(C)CCC=C(C)C)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC(C)CCC=C(C)C)CC(=O)O

InChI

InChI=1S/C28H33NO4/c1-19(2)7-5-8-20(3)15-16-33-24-13-11-22(12-14-24)28(32)29-21(4)17-25-23(18-27(30)31)9-6-10-26(25)29/h6-7,9-14,17,20H,5,8,15-16,18H2,1-4H3,(H,30,31)