methyl 4-[(Z)-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[(4-oxo-3-pentyl-phthalazine-1-carbonyl)hydrazono]methyl]benzoate CAS Name: 4-[(Z)-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[(4-oxo-3-pentylphthalazine-1-carbonyl)hydrazinylidene]methyl]benzoate Traditional Name: 4-[(Z)-[(3-amyl-4-keto-phthalazine-1-carbonyl)hydrazono]methyl]benzoic acid methyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H24N4O4/c1-3-4-7-14-27-22(29)19-9-6-5-8-18(19)20(26-27)21(28)25-24-15-16-10-12-17(13-11-16)23(30)31-2/h5-6,8-13,15H,3-4,7,14H2,1-2H3,(H,25,28)/b24-15-