4-(4-butan-2-ylphenyl)-2H-phthalazin-1-one

Systemtic Name: 4-(4-butan-2-ylphenyl)-2H-phthalazin-1-one Openeye Name: 4-(4-sec-butylphenyl)-2H-phthalazin-1-one CAS Name: 4-(4-butan-2-ylphenyl)-2H-phthalazin-1-one IUPAC Name: 4-(4-butan-2-ylphenyl)-2H-phthalazin-1-one Traditional Name: 4-(4-sec-butylphenyl)-2H-phthalazin-1-one Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O/c1-3-12(2)13-8-10-14(11-9-13)17-15-6-4-5-7-16(15)18(21)20-19-17/h4-12H,3H2,1-2H3,(H,20,21)