N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N4O5/c23-16(11-5-7-12(8-6-11)22(26)27)10-19-17(24)9-15-13-3-1-2-4-14(13)18(25)21-20-15/h1-8,16,23H,9-10H2,(H,19,24)(H,21,25)