ethyl 2-(4-ethoxycarbonylphenyl)-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate

Systemtic Name: ethyl 2-(4-ethoxycarbonylphenyl)-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate Openeye Name: ethyl 2-(4-ethoxycarbonylphenyl)-1,3-dioxo-4H-isoquinoline-4-carboxylate CAS Name: 2-(4-ethoxycarbonylphenyl)-1,3-dioxo-4H-isoquinoline-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-ethoxycarbonylphenyl)-1,3-dioxo-4H-isoquinoline-4-carboxylate Traditional Name: 2-(4-carbethoxyphenyl)-1,3-diketo-4H-isoquinoline-4-carboxylic acid ethyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C21H19NO6/c1-3-27-20(25)13-9-11-14(12-10-13)22-18(23)16-8-6-5-7-15(16)17(19(22)24)21(26)28-4-2/h5-12,17H,3-4H2,1-2H3