N-[1-(3,3-dimethylbutyl)-4-oxidanylidene-3H-phthalazin-6-yl]-2-propyl-pentanamide

Systemtic Name: N-[1-(3,3-dimethylbutyl)-4-oxidanylidene-3H-phthalazin-6-yl]-2-propyl-pentanamide Openeye Name: N-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-2-propyl-pentanamide CAS Name: N-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-2-propylpentanamide IUPAC Name: N-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-2-propylpentanamide Traditional Name: N-[1-(3,3-dimethylbutyl)-4-keto-3H-phthalazin-6-yl]-2-propyl-valeramide Formula: C22H33N3O2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CCC(C)(C)C

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(C=C1)C(=NNC2=O)CCC(C)(C)C

InChI

InChI=1S/C22H33N3O2/c1-6-8-15(9-7-2)20(26)23-16-10-11-17-18(14-16)21(27)25-24-19(17)12-13-22(3,4)5/h10-11,14-15H,6-9,12-13H2,1-5H3,(H,23,26)(H,25,27)