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

Systemtic Name: 2-[5-butan-2-yl-2-(4-methylphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(p-tolyl)-5-sec-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-(4-methylphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-(4-methylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(p-tolyl)-5-sec-butyl-1H-indol-3-yl]acetic acid Formula: C21H23NO2 MolecularWeight: 321.41282

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO2/c1-4-14(3)16-9-10-19-17(11-16)18(12-20(23)24)21(22-19)15-7-5-13(2)6-8-15/h5-11,14,22H,4,12H2,1-3H3,(H,23,24)