2-[2-(3-methoxy-4-phenylmethoxy-phenyl)-5-methyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3-methoxy-4-phenylmethoxy-phenyl)-5-methyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-methoxy-phenyl)-5-methyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3-methoxy-4-phenylmethoxyphenyl)-5-methyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3-methoxy-4-phenylmethoxyphenyl)-5-methyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-methoxy-phenyl)-5-methyl-1H-indol-3-yl]acetic acid Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H23NO4/c1-16-8-10-21-19(12-16)20(14-24(27)28)25(26-21)18-9-11-22(23(13-18)29-2)30-15-17-6-4-3-5-7-17/h3-13,26H,14-15H2,1-2H3,(H,27,28)