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

Systemtic Name: N-[4-(cyanomethoxy)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[4-(cyanomethoxy)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[4-(cyanomethoxy)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(cyanomethoxy)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[4-(cyanomethoxy)phenyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OCC#N

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C20H18N4O3/c1-2-12-24-20(26)17-6-4-3-5-16(17)18(23-24)19(25)22-14-7-9-15(10-8-14)27-13-11-21/h3-10H,2,12-13H2,1H3,(H,22,25)