3-butyl-4-oxidanylidene-N-(2,4,6-trimethylphenyl)phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-(2,4,6-trimethylphenyl)phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-(2,4,6-trimethylphenyl)phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-(2,4,6-trimethylphenyl)-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-(2,4,6-trimethylphenyl)phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-mesityl-phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C22H25N3O2/c1-5-6-11-25-22(27)18-10-8-7-9-17(18)20(24-25)21(26)23-19-15(3)12-14(2)13-16(19)4/h7-10,12-13H,5-6,11H2,1-4H3,(H,23,26)