2-(4-chloranylphenoxy)ethyl 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate

Systemtic Name: 2-(4-chloranylphenoxy)ethyl 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate Openeye Name: 2-(4-chlorophenoxy)ethyl 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoic acid 2-(4-chlorophenoxy)ethyl ester IUPAC Name: 2-(4-chlorophenoxy)ethyl 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)propionic acid 2-(4-chlorophenoxy)ethyl ester Formula: C20H18ClNO5 MolecularWeight: 387.81362

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)OCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)OCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO5/c21-15-5-7-16(8-6-15)26-11-12-27-19(24)9-10-22-18(23)13-14-3-1-2-4-17(14)20(22)25/h1-8H,9-13H2