N-[(2-methylphenyl)methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[(2-methylphenyl)methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(o-tolylmethyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-(2-methylbenzyl)phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3C

InChI

InChI=1S/C22H25N3O2/c1-3-4-9-14-25-22(27)19-13-8-7-12-18(19)20(24-25)21(26)23-15-17-11-6-5-10-16(17)2/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,23,26)