2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N4O5/c1-21-18(25)14-5-3-2-4-13(14)15(20-21)9-17(24)19-10-11-8-12(22(26)27)6-7-16(11)23/h2-8,23H,9-10H2,1H3,(H,19,24)