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

Systemtic Name: 2-[5-butan-2-yl-2-(4-ethoxy-3-methoxy-phenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-ethoxy-3-methoxy-phenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-(4-ethoxy-3-methoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-(4-ethoxy-3-methoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-ethoxy-3-methoxy-phenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC)OC

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OCC)OC

InChI

InChI=1S/C23H27NO4/c1-5-14(3)15-7-9-19-17(11-15)18(13-22(25)26)23(24-19)16-8-10-20(28-6-2)21(12-16)27-4/h7-12,14,24H,5-6,13H2,1-4H3,(H,25,26)