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

Systemtic Name: N-(4-aminocarbonylphenyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(4-carbamoylphenyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(4-carbamoylphenyl)-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(4-carbamoylphenyl)-4-keto-phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H22N4O3/c1-2-3-6-13-25-21(28)17-8-5-4-7-16(17)18(24-25)20(27)23-15-11-9-14(10-12-15)19(22)26/h4-5,7-12H,2-3,6,13H2,1H3,(H2,22,26)(H,23,27)