(E)-2-[3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxidanylidene-phthalazin-1-yl]-2-oxidanyl-ethenediazonium

Systemtic Name: (E)-2-[3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxidanylidene-phthalazin-1-yl]-2-oxidanyl-ethenediazonium Openeye Name: (E)-2-[3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxo-phthalazin-1-yl]-2-hydroxy-ethenediazonium CAS Name: (E)-2-[3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxo-1-phthalazinyl]-2-hydroxyethenediazonium IUPAC Name: (E)-2-[3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxophthalazin-1-yl]-2-hydroxyethenediazonium Traditional Name: (E)-2-[3-(3,4-dichlorobenzyl)-4-keto-6-methoxy-phthalazin-1-yl]-2-hydroxy-ethenediazonium Formula: C18H13Cl2N4O3+ MolecularWeight: 404.22682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)C(=C[N+]#N)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)/C(=C\[N+]#N)/O

InChI

InChI=1S/C18H12Cl2N4O3/c1-27-11-3-4-12-13(7-11)18(26)24(23-17(12)16(25)8-22-21)9-10-2-5-14(19)15(20)6-10/h2-8H,9H2,1H3/p+1/b16-8+