N-[2-(2,4-dimethylphenoxy)ethyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O3/c1-17-12-13-22(18(2)16-17)31-15-14-26-24(29)23-20-10-6-7-11-21(20)25(30)28(27-23)19-8-4-3-5-9-19/h3-13,16H,14-15H2,1-2H3,(H,26,29)