methyl 2-ethoxy-3-[4-[2-(1-oxidanylideneisoquinolin-2-yl)ethoxy]phenyl]propanoate

Systemtic Name: methyl 2-ethoxy-3-[4-[2-(1-oxidanylideneisoquinolin-2-yl)ethoxy]phenyl]propanoate Openeye Name: methyl 2-ethoxy-3-[4-[2-(1-oxo-2-isoquinolyl)ethoxy]phenyl]propanoate CAS Name: 2-ethoxy-3-[4-[2-(1-oxo-2-isoquinolinyl)ethoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-ethoxy-3-[4-[2-(1-oxoisoquinolin-2-yl)ethoxy]phenyl]propanoate Traditional Name: 2-ethoxy-3-[4-[2-(1-keto-2-isoquinolyl)ethoxy]phenyl]propionic acid methyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C=CC3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C=CC3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C23H25NO5/c1-3-28-21(23(26)27-2)16-17-8-10-19(11-9-17)29-15-14-24-13-12-18-6-4-5-7-20(18)22(24)25/h4-13,21H,3,14-16H2,1-2H3