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

Systemtic Name: 2-[2-methyl-1-[4-[2-(3-methylphenyl)ethoxy]phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[4-[2-(m-tolyl)ethoxy]benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[[4-[2-(3-methylphenyl)ethoxy]phenyl]-oxomethyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-[2-(3-methylphenyl)ethoxy]benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[4-[2-(m-tolyl)ethoxy]benzoyl]indol-4-yl]acetic acid Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCOC2=CC=C(C=C2)C(=O)N3C(=CC4=C(C=CC=C43)CC(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)CCOC2=CC=C(C=C2)C(=O)N3C(=CC4=C(C=CC=C43)CC(=O)O)C

InChI

InChI=1S/C27H25NO4/c1-18-5-3-6-20(15-18)13-14-32-23-11-9-21(10-12-23)27(31)28-19(2)16-24-22(17-26(29)30)7-4-8-25(24)28/h3-12,15-16H,13-14,17H2,1-2H3,(H,29,30)