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

Systemtic Name: N-(2-butan-2-ylphenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-(2-sec-butylphenyl)phthalazine-1-carboxamide CAS Name: N-(2-butan-2-ylphenyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-butan-2-ylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(2-sec-butylphenyl)phthalazine-1-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2/c1-4-13(2)14-9-7-8-12-17(14)21-19(24)18-15-10-5-6-11-16(15)20(25)23(3)22-18/h5-13H,4H2,1-3H3,(H,21,24)