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

Systemtic Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one Openeye Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one CAS Name: 4-[4-(2-hydroxyethylamino)-3-nitrophenyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(2-hydroxyethylamino)-3-nitrophenyl]-2H-phthalazin-1-one Traditional Name: 4-[4-(2-hydroxyethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O4/c21-8-7-17-13-6-5-10(9-14(13)20(23)24)15-11-3-1-2-4-12(11)16(22)19-18-15/h1-6,9,17,21H,7-8H2,(H,19,22)