3-butyl-N'-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-butyl-N'-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-butyl-N'-[1-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-butyl-N'-[1-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)ethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-butyl-N'-[1-(3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-butyl-N'-[1-(3-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)ethyl]-4-keto-phthalazine-1-carbohydrazide Formula: C21H21FN4O3 MolecularWeight: 396.414843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=C3C=C(C=CC3=O)F)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=C3C=C(C=CC3=O)F)C

InChI

InChI=1S/C21H21FN4O3/c1-3-4-11-26-21(29)16-8-6-5-7-15(16)19(25-26)20(28)24-23-13(2)17-12-14(22)9-10-18(17)27/h5-10,12,23H,3-4,11H2,1-2H3,(H,24,28)