ethyl 4-[2-(2-ethyl-1-oxidanylidene-isoquinolin-5-yl)oxyethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-ethyl-1-oxidanylidene-isoquinolin-5-yl)oxyethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2-ethyl-1-oxo-5-isoquinolyl)oxy]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2-ethyl-1-oxo-5-isoquinolinyl)oxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-ethyl-1-oxoisoquinolin-5-yl)oxyacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2-ethyl-1-keto-5-isoquinolyl)oxy]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H25N3O5/c1-3-21-9-8-15-16(19(21)25)6-5-7-17(15)28-14-18(24)22-10-12-23(13-11-22)20(26)27-4-2/h5-9H,3-4,10-14H2,1-2H3