2-chloranyl-5-[2-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinyl]benzoate

Systemtic Name: 2-chloranyl-5-[2-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylhydrazinyl]benzoate Openeye Name: 2-chloro-5-[2-(4-oxo-3-propyl-phthalazine-1-carbonyl)hydrazino]benzoate CAS Name: 2-chloro-5-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]hydrazo]benzoate IUPAC Name: 2-chloro-5-[2-(4-oxo-3-propylphthalazine-1-carbonyl)hydrazinyl]benzoate Traditional Name: 2-chloro-5-[N'-(4-keto-3-propyl-phthalazine-1-carbonyl)hydrazino]benzoate Formula: C19H16ClN4O4- MolecularWeight: 399.80774

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC3=CC(=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC3=CC(=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C19H17ClN4O4/c1-2-9-24-18(26)13-6-4-3-5-12(13)16(23-24)17(25)22-21-11-7-8-15(20)14(10-11)19(27)28/h3-8,10,21H,2,9H2,1H3,(H,22,25)(H,27,28)/p-1