ethyl 4-[2-[5-(2-methoxy-2-oxidanylidene-ethoxy)-1-oxidanylidene-isoquinolin-2-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[5-(2-methoxy-2-oxidanylidene-ethoxy)-1-oxidanylidene-isoquinolin-2-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-(2-methoxy-2-oxo-ethoxy)-1-oxo-2-isoquinolyl]acetyl]amino]benzoate CAS Name: 4-[[2-[5-(2-methoxy-2-oxoethoxy)-1-oxo-2-isoquinolinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[5-(2-methoxy-2-oxoethoxy)-1-oxoisoquinolin-2-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-keto-5-(2-keto-2-methoxy-ethoxy)-2-isoquinolyl]acetyl]amino]benzoic acid ethyl ester Formula: C23H22N2O7 MolecularWeight: 438.42998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C(C2=O)C=CC=C3OCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C(C2=O)C=CC=C3OCC(=O)OC

InChI

InChI=1S/C23H22N2O7/c1-3-31-23(29)15-7-9-16(10-8-15)24-20(26)13-25-12-11-17-18(22(25)28)5-4-6-19(17)32-14-21(27)30-2/h4-12H,3,13-14H2,1-2H3,(H,24,26)