N-[(4-aminocarbonylphenyl)methyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-N-methyl-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-N-methyl-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-N-methyl-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(4-carbamoylbenzyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C23H26N4O3/c1-3-4-7-14-27-22(29)19-9-6-5-8-18(19)20(25-27)23(30)26(2)15-16-10-12-17(13-11-16)21(24)28/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H2,24,28)