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

Systemtic Name: 2-[2-methyl-1-(4-phenylmethoxyphenyl)carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-(4-benzyloxybenzoyl)-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-(4-phenylmethoxyphenyl)methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-(4-phenylmethoxybenzoyl)indol-4-yl]acetic acid Traditional Name: 2-[1-(4-benzoxybenzoyl)-2-methyl-indol-4-yl]acetic acid Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C25H21NO4/c1-17-14-22-20(15-24(27)28)8-5-9-23(22)26(17)25(29)19-10-12-21(13-11-19)30-16-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3,(H,27,28)