[3-oxidanylidene-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] butanoate

Systemtic Name: [3-oxidanylidene-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] butanoate Openeye Name: [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-yl] butanoate CAS Name: butanoic acid [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] ester IUPAC Name: [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] butanoate Traditional Name: butyric acid [3-keto-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-yl] ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CCCC(=O)OC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O3/c1-2-9-24(29)31-26-23-13-7-6-12-22(23)25(30)28(26)17-8-16-27-18-14-21(15-19-27)20-10-4-3-5-11-20/h3-7,10-14,26H,2,8-9,15-19H2,1H3