ethyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinylidene]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinylidene]piperidine-1-carboxylate Openeye Name: ethyl 4-[(4-oxo-3-propyl-phthalazine-1-carbonyl)hydrazono]piperidine-1-carboxylate CAS Name: 4-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]hydrazinylidene]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-oxo-3-propylphthalazine-1-carbonyl)hydrazinylidene]piperidine-1-carboxylate Traditional Name: 4-[(4-keto-3-propyl-phthalazine-1-carbonyl)hydrazono]piperidine-1-carboxylic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H25N5O4/c1-3-11-25-19(27)16-8-6-5-7-15(16)17(23-25)18(26)22-21-14-9-12-24(13-10-14)20(28)29-4-2/h5-8H,3-4,9-13H2,1-2H3,(H,22,26)