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

Systemtic Name: 4-oxidanylidene-3-pentyl-N-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-benzyl-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-benzyl-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-benzyl-4-keto-phthalazine-1-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-2-3-9-14-24-21(26)18-13-8-7-12-17(18)19(23-24)20(25)22-15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3,(H,22,25)