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

Systemtic Name: 2-[2-methyl-1-[2-(4-phenylbutoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[2-(4-phenylbutoxy)benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-[2-(4-phenylbutoxy)phenyl]methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[2-(4-phenylbutoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[2-(4-phenylbutoxy)benzoyl]indol-4-yl]acetic acid Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=CC=C3OCCCCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=CC=C3OCCCCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C28H27NO4/c1-20-18-24-22(19-27(30)31)13-9-15-25(24)29(20)28(32)23-14-5-6-16-26(23)33-17-8-7-12-21-10-3-2-4-11-21/h2-6,9-11,13-16,18H,7-8,12,17,19H2,1H3,(H,30,31)