ethyl 4-[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]-4-pyridin-4-yl-butanoate

Systemtic Name: ethyl 4-[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]-4-pyridin-4-yl-butanoate Openeye Name: ethyl 4-[3-(3-ethoxy-3-oxo-propyl)phenyl]-4-(4-pyridyl)butanoate CAS Name: 4-[3-(3-ethoxy-3-oxopropyl)phenyl]-4-pyridin-4-ylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(3-ethoxy-3-oxopropyl)phenyl]-4-pyridin-4-ylbutanoate Traditional Name: 4-[3-(3-ethoxy-3-keto-propyl)phenyl]-4-(4-pyridyl)butyric acid ethyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=CC=C1)C(CCC(=O)OCC)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)CCC1=CC(=CC=C1)C(CCC(=O)OCC)C2=CC=NC=C2

InChI

InChI=1S/C22H27NO4/c1-3-26-21(24)10-8-17-6-5-7-19(16-17)20(9-11-22(25)27-4-2)18-12-14-23-15-13-18/h5-7,12-16,20H,3-4,8-11H2,1-2H3