ethyl 2-[5-heptoxy-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-heptoxy-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]ethanoate Openeye Name: ethyl 2-[5-heptoxy-3-(2-imidazol-1-ylethyl)indolin-1-yl]acetate CAS Name: 2-[5-heptoxy-3-[2-(1-imidazolyl)ethyl]-2,3-dihydroindol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-heptoxy-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]acetate Traditional Name: 2-[5-heptoxy-3-(2-imidazol-1-ylethyl)indolin-1-yl]acetic acid ethyl ester Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CC(=O)OCC

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)N(CC2CCN3C=CN=C3)CC(=O)OCC

InChI

InChI=1S/C24H35N3O3/c1-3-5-6-7-8-15-30-21-9-10-23-22(16-21)20(11-13-26-14-12-25-19-26)17-27(23)18-24(28)29-4-2/h9-10,12,14,16,19-20H,3-8,11,13,15,17-18H2,1-2H3