2-[5-butan-2-yl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-butan-2-yl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-sec-butyl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-sec-butyl-2-(2,3,4-trimethoxyphenyl)-1H-indol-3-yl]acetic acid Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO5/c1-6-13(2)14-7-9-18-16(11-14)17(12-20(25)26)21(24-18)15-8-10-19(27-3)23(29-5)22(15)28-4/h7-11,13,24H,6,12H2,1-5H3,(H,25,26)