ethyl 3-[4-[3-(2,3-dihydroindol-1-yl)prop-1-ynyl]phenyl]-2-ethoxy-propanoate

Systemtic Name: ethyl 3-[4-[3-(2,3-dihydroindol-1-yl)prop-1-ynyl]phenyl]-2-ethoxy-propanoate Openeye Name: ethyl 2-ethoxy-3-[4-(3-indolin-1-ylprop-1-ynyl)phenyl]propanoate CAS Name: 3-[4-[3-(2,3-dihydroindol-1-yl)prop-1-ynyl]phenyl]-2-ethoxypropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[3-(2,3-dihydroindol-1-yl)prop-1-ynyl]phenyl]-2-ethoxypropanoate Traditional Name: 2-ethoxy-3-[4-(3-indolin-1-ylprop-1-ynyl)phenyl]propionic acid ethyl ester Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)C#CCN2CCC3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)C#CCN2CCC3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C24H27NO3/c1-3-27-23(24(26)28-4-2)18-20-13-11-19(12-14-20)8-7-16-25-17-15-21-9-5-6-10-22(21)25/h5-6,9-14,23H,3-4,15-18H2,1-2H3