N-[2-(4-methylphenoxy)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(4-methylphenoxy)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-(4-methylphenoxy)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[2-(4-methylphenoxy)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-methylphenoxy)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(4-methylphenoxy)phenyl]-3-propyl-phthalazine-1-carboxamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3OC4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3OC4=CC=C(C=C4)C

InChI

InChI=1S/C25H23N3O3/c1-3-16-28-25(30)20-9-5-4-8-19(20)23(27-28)24(29)26-21-10-6-7-11-22(21)31-18-14-12-17(2)13-15-18/h4-15H,3,16H2,1-2H3,(H,26,29)