4-[(E)-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[(4-oxo-3-propyl-phthalazine-1-carbonyl)hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[(4-oxo-3-propylphthalazine-1-carbonyl)hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[(4-keto-3-propyl-phthalazine-1-carbonyl)hydrazono]methyl]benzoic acid Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N4O4/c1-2-11-24-19(26)16-6-4-3-5-15(16)17(23-24)18(25)22-21-12-13-7-9-14(10-8-13)20(27)28/h3-10,12H,2,11H2,1H3,(H,22,25)(H,27,28)/b21-12+