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

Systemtic Name: N-(4-butylphenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(4-butylphenyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(4-butylphenyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(4-butylphenyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(4-butylphenyl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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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)CCC

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2/c1-3-5-8-16-11-13-17(14-12-16)23-21(26)20-18-9-6-7-10-19(18)22(27)25(24-20)15-4-2/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,23,26)