2-[2-(4-chloranylphenoxy)ethyl]phthalazin-1-one; ethanedioic acid

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethyl]phthalazin-1-one; ethanedioic acid Openeye Name: 2-[2-(4-chlorophenoxy)ethyl]phthalazin-1-one; oxalic acid CAS Name: 2-[2-(4-chlorophenoxy)ethyl]-1-phthalazinone; oxalic acid IUPAC Name: 2-[2-(4-chlorophenoxy)ethyl]phthalazin-1-one; oxalic acid Traditional Name: 2-[2-(4-chlorophenoxy)ethyl]phthalazin-1-one; oxalic acid Formula: C18H15ClN2O6 MolecularWeight: 390.7745

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CCOC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CCOC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H13ClN2O2.C2H2O4/c17-13-5-7-14(8-6-13)21-10-9-19-16(20)15-4-2-1-3-12(15)11-18-19;3-1(4)2(5)6/h1-8,11H,9-10H2;(H,3,4)(H,5,6)