3-butyl-N'-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-butyl-N'-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-butyl-N'-[(3-chloro-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-butyl-N'-[(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-butyl-N'-[(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-butyl-N'-[(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-4-keto-phthalazine-1-carbohydrazide Formula: C20H18ClN5O5 MolecularWeight: 443.84042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C3C=C(C=C(C3=O)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C3C=C(C=C(C3=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H18ClN5O5/c1-2-3-8-25-20(29)15-7-5-4-6-14(15)17(24-25)19(28)23-22-11-12-9-13(21)10-16(18(12)27)26(30)31/h4-7,9-11,22H,2-3,8H2,1H3,(H,23,28)