methyl 4-[2-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolyl]oxy]acetyl]amino]benzoate CAS Name: 4-[[2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-(2-methoxyethyl)-1-oxoisoquinolin-5-yl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[[1-keto-2-(2-methoxyethyl)-5-isoquinolyl]oxy]acetyl]amino]benzoic acid methyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O6/c1-28-13-12-24-11-10-17-18(21(24)26)4-3-5-19(17)30-14-20(25)23-16-8-6-15(7-9-16)22(27)29-2/h3-11H,12-14H2,1-2H3,(H,23,25)