4-[4-(3-methylbutyl)phenyl]-2H-phthalazin-1-one

Systemtic Name: 4-[4-(3-methylbutyl)phenyl]-2H-phthalazin-1-one Openeye Name: 4-(4-isopentylphenyl)-2H-phthalazin-1-one CAS Name: 4-[4-(3-methylbutyl)phenyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(3-methylbutyl)phenyl]-2H-phthalazin-1-one Traditional Name: 4-(4-isoamylphenyl)-2H-phthalazin-1-one Formula: C19H20N2O MolecularWeight: 292.3749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)CCC1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H20N2O/c1-13(2)7-8-14-9-11-15(12-10-14)18-16-5-3-4-6-17(16)19(22)21-20-18/h3-6,9-13H,7-8H2,1-2H3,(H,21,22)