5-azanyl-N-[[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]methyl]pentanamide

Systemtic Name: 5-azanyl-N-[[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]methyl]pentanamide Openeye Name: 5-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]pentanamide CAS Name: 5-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]pentanamide IUPAC Name: 5-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]pentanamide Traditional Name: 5-amino-N-[3-(4-keto-3H-phthalazin-1-yl)benzyl]valeramide Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)CNC(=O)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)CNC(=O)CCCCN

InChI

InChI=1S/C20H22N4O2/c21-11-4-3-10-18(25)22-13-14-6-5-7-15(12-14)19-16-8-1-2-9-17(16)20(26)24-23-19/h1-2,5-9,12H,3-4,10-11,13,21H2,(H,22,25)(H,24,26)