4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one

Systemtic Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one CAS Name: 4-[4-(2-hydroxyethylamino)-3-nitrophenyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-(2-hydroxyethylamino)-3-nitrophenyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O4/c1-20-17(23)13-5-3-2-4-12(13)16(19-20)11-6-7-14(18-8-9-22)15(10-11)21(24)25/h2-7,10,18,22H,8-9H2,1H3