2-[6,7-dimethyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6,7-dimethyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3-benzyloxyphenyl)-6,7-dimethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[6,7-dimethyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[6,7-dimethyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3-benzoxyphenyl)-6,7-dimethyl-1H-indol-3-yl]acetic acid Formula: C25H23NO3 MolecularWeight: 385.45502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(N2)C3=CC(=CC=C3)OCC4=CC=CC=C4)CC(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(N2)C3=CC(=CC=C3)OCC4=CC=CC=C4)CC(=O)O)C

InChI

InChI=1S/C25H23NO3/c1-16-11-12-21-22(14-23(27)28)25(26-24(21)17(16)2)19-9-6-10-20(13-19)29-15-18-7-4-3-5-8-18/h3-13,26H,14-15H2,1-2H3,(H,27,28)