N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(3-fluoro-4-methoxy-benzyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C23H26FN3O3 MolecularWeight: 411.469243

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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)OC)F

Isomeric SMILES

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

InChI

InChI=1S/C23H26FN3O3/c1-4-5-8-13-27-22(28)18-10-7-6-9-17(18)21(25-27)23(29)26(2)15-16-11-12-20(30-3)19(24)14-16/h6-7,9-12,14H,4-5,8,13,15H2,1-3H3