ethyl 3-[3-(2-imidazol-1-ylethyl)-5-pentyl-2,3-dihydroindol-1-yl]propanoate

Systemtic Name: ethyl 3-[3-(2-imidazol-1-ylethyl)-5-pentyl-2,3-dihydroindol-1-yl]propanoate Openeye Name: ethyl 3-[3-(2-imidazol-1-ylethyl)-5-pentyl-indolin-1-yl]propanoate CAS Name: 3-[3-[2-(1-imidazolyl)ethyl]-5-pentyl-2,3-dihydroindol-1-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(2-imidazol-1-ylethyl)-5-pentyl-2,3-dihydroindol-1-yl]propanoate Traditional Name: 3-[5-amyl-3-(2-imidazol-1-ylethyl)indolin-1-yl]propionic acid ethyl ester Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CCC(=O)OCC

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CCC(=O)OCC

InChI

InChI=1S/C23H33N3O2/c1-3-5-6-7-19-8-9-22-21(16-19)20(10-13-25-15-12-24-18-25)17-26(22)14-11-23(27)28-4-2/h8-9,12,15-16,18,20H,3-7,10-11,13-14,17H2,1-2H3