2-[2-methyl-1-[4-(3-methylbutoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-(3-methylbutoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-(4-isopentyloxybenzoyl)-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[[4-(3-methylbutoxy)phenyl]-oxomethyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-(3-methylbutoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[1-(4-isoamoxybenzoyl)-2-methyl-indol-4-yl]acetic acid Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO4/c1-15(2)11-12-28-19-9-7-17(8-10-19)23(27)24-16(3)13-20-18(14-22(25)26)5-4-6-21(20)24/h4-10,13,15H,11-12,14H2,1-3H3,(H,25,26)