2-[5-butan-2-yl-2-(3-phenoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-butan-2-yl-2-(3-phenoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3-phenoxyphenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3-phenoxyphenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H25NO3/c1-3-17(2)18-12-13-24-22(15-18)23(16-25(28)29)26(27-24)19-8-7-11-21(14-19)30-20-9-5-4-6-10-20/h4-15,17,27H,3,16H2,1-2H3,(H,28,29)