3-[2-(4-bromanylphenoxy)ethyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-(4-bromophenoxy)ethyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-(4-bromophenoxy)ethyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-(4-bromophenoxy)ethyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-(4-bromophenoxy)ethyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C18H16BrN3O3 MolecularWeight: 402.24194

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCOC3=CC=C(C=C3)Br

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3O3/c1-20-17(23)16-14-4-2-3-5-15(14)18(24)22(21-16)10-11-25-13-8-6-12(19)7-9-13/h2-9H,10-11H2,1H3,(H,20,23)