N-[4-(cyanomethoxy)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[4-(cyanomethoxy)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[4-(cyanomethoxy)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(cyanomethoxy)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[4-(cyanomethoxy)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[4-(cyanomethoxy)phenyl]-4-keto-phthalazine-1-carboxamide Formula: C24H18N4O3 MolecularWeight: 410.42472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=C(C=C4)OCC#N

InChI

InChI=1S/C24H18N4O3/c25-14-15-31-19-12-10-18(11-13-19)26-23(29)22-20-8-4-5-9-21(20)24(30)28(27-22)16-17-6-2-1-3-7-17/h1-13H,15-16H2,(H,26,29)