ethyl 2-[4-[(3-chloranylisoquinolin-1-yl)amino]phenoxy]propanoate

Systemtic Name: ethyl 2-[4-[(3-chloranylisoquinolin-1-yl)amino]phenoxy]propanoate Openeye Name: ethyl 2-[4-[(3-chloro-1-isoquinolyl)amino]phenoxy]propanoate CAS Name: 2-[4-[(3-chloro-1-isoquinolinyl)amino]phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[(3-chloroisoquinolin-1-yl)amino]phenoxy]propanoate Traditional Name: 2-[4-[(3-chloro-1-isoquinolyl)amino]phenoxy]propionic acid ethyl ester Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=C(C=C1)NC2=NC(=CC3=CC=CC=C32)Cl

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=C(C=C1)NC2=NC(=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C20H19ClN2O3/c1-3-25-20(24)13(2)26-16-10-8-15(9-11-16)22-19-17-7-5-4-6-14(17)12-18(21)23-19/h4-13H,3H2,1-2H3,(H,22,23)