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

Systemtic Name: 2-[1-[4-[2-(4-cyanophenyl)ethoxy]phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-[2-(4-cyanophenyl)ethoxy]benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[[4-[2-(4-cyanophenyl)ethoxy]phenyl]-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-[4-[2-(4-cyanophenyl)ethoxy]benzoyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-[4-[2-(4-cyanophenyl)ethoxy]benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC=C(C=C4)C#N)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCC4=CC=C(C=C4)C#N)CC(=O)O

InChI

InChI=1S/C27H22N2O4/c1-18-15-24-22(16-26(30)31)3-2-4-25(24)29(18)27(32)21-9-11-23(12-10-21)33-14-13-19-5-7-20(17-28)8-6-19/h2-12,15H,13-14,16H2,1H3,(H,30,31)