N-(2-butan-2-ylphenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(2-butan-2-ylphenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-(2-sec-butylphenyl)-3H-phthalazine-1-carboxamide CAS Name: N-(2-butan-2-ylphenyl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(2-butan-2-ylphenyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-(2-sec-butylphenyl)-3H-phthalazine-1-carboxamide Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H19N3O2/c1-3-12(2)13-8-6-7-11-16(13)20-19(24)17-14-9-4-5-10-15(14)18(23)22-21-17/h4-12H,3H2,1-2H3,(H,20,24)(H,22,23)