N-(4-butylphenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

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