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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OC)OCC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OC)OCC

InChI

InChI=1S/C23H27NO4/c1-4-6-7-15-8-10-19-17(12-15)18(14-22(25)26)23(24-19)16-9-11-20(27-3)21(13-16)28-5-2/h8-13,24H,4-7,14H2,1-3H3,(H,25,26)