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

Systemtic Name: 3-[[2-(4-chloranylphenoxy)ethyl-methyl-amino]methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O3/c1-22-19(26)18-16-5-3-4-6-17(16)20(27)25(23-18)13-24(2)11-12-28-15-9-7-14(21)8-10-15/h3-10H,11-13H2,1-2H3,(H,22,26)