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

Systemtic Name: ethyl 4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propoxy]benzoate Openeye Name: ethyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propoxy]benzoate CAS Name: 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propoxy]benzoate Traditional Name: 4-[3-(1,3-diketo-4H-isoquinolin-2-yl)propoxy]benzoic acid ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCCCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCCCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO5/c1-2-26-21(25)15-8-10-17(11-9-15)27-13-5-12-22-19(23)14-16-6-3-4-7-18(16)20(22)24/h3-4,6-11H,2,5,12-14H2,1H3