ethyl 2,5-dimethyl-4-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[1-oxo-2-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethoxy]ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[2-(4-keto-3H-phthalazin-1-yl)acetyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C21H21N3O6/c1-4-29-21(28)19-12(3)22-11(2)18(19)16(25)10-30-17(26)9-15-13-7-5-6-8-14(13)20(27)24-23-15/h5-8,22H,4,9-10H2,1-3H3,(H,24,27)