ethyl 2-[3-(2-imidazol-1-ylethyl)-6-nonoxy-2,3-dihydroindol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-(2-imidazol-1-ylethyl)-6-nonoxy-2,3-dihydroindol-1-yl]ethanoate Openeye Name: ethyl 2-[3-(2-imidazol-1-ylethyl)-6-nonoxy-indolin-1-yl]acetate CAS Name: 2-[3-[2-(1-imidazolyl)ethyl]-6-nonoxy-2,3-dihydroindol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-imidazol-1-ylethyl)-6-nonoxy-2,3-dihydroindol-1-yl]acetate Traditional Name: 2-[3-(2-imidazol-1-ylethyl)-6-nonoxy-indolin-1-yl]acetic acid ethyl ester Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC2=C(C=C1)C(CN2CC(=O)OCC)CCN3C=CN=C3

Isomeric SMILES

CCCCCCCCCOC1=CC2=C(C=C1)C(CN2CC(=O)OCC)CCN3C=CN=C3

InChI

InChI=1S/C26H39N3O3/c1-3-5-6-7-8-9-10-17-32-23-11-12-24-22(13-15-28-16-14-27-21-28)19-29(25(24)18-23)20-26(30)31-4-2/h11-12,14,16,18,21-22H,3-10,13,15,17,19-20H2,1-2H3