N'-(3-bromophenyl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-bromophenyl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(3-bromobenzoyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[(3-bromophenyl)-oxomethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(3-bromobenzoyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-(3-bromobenzoyl)-4-keto-phthalazine-1-carbohydrazide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H21BrN4O3/c1-2-3-6-12-26-21(29)17-11-5-4-10-16(17)18(25-26)20(28)24-23-19(27)14-8-7-9-15(22)13-14/h4-5,7-11,13H,2-3,6,12H2,1H3,(H,23,27)(H,24,28)