3-[3-(2-imidazol-1-ylethyl)-5-octoxy-2,3-dihydroindol-1-yl]propanoic acid

Systemtic Name: 3-[3-(2-imidazol-1-ylethyl)-5-octoxy-2,3-dihydroindol-1-yl]propanoic acid Openeye Name: 3-[3-(2-imidazol-1-ylethyl)-5-octoxy-indolin-1-yl]propanoic acid CAS Name: 3-[3-[2-(1-imidazolyl)ethyl]-5-octoxy-2,3-dihydroindol-1-yl]propanoic acid IUPAC Name: 3-[3-(2-imidazol-1-ylethyl)-5-octoxy-2,3-dihydroindol-1-yl]propanoic acid Traditional Name: 3-[3-(2-imidazol-1-ylethyl)-5-octoxy-indolin-1-yl]propionic acid Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CCC(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CCC(=O)O

InChI

InChI=1S/C24H35N3O3/c1-2-3-4-5-6-7-16-30-21-8-9-23-22(17-21)20(10-13-26-15-12-25-19-26)18-27(23)14-11-24(28)29/h8-9,12,15,17,19-20H,2-7,10-11,13-14,16,18H2,1H3,(H,28,29)