2-(3-nitro-4-oxidanyl-phenyl)-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]ethanamide

Systemtic Name: 2-(3-nitro-4-oxidanyl-phenyl)-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]ethanamide Openeye Name: 2-(4-hydroxy-3-nitro-phenyl)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]acetamide CAS Name: 2-(4-hydroxy-3-nitrophenyl)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]acetamide IUPAC Name: 2-(4-hydroxy-3-nitrophenyl)-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]acetamide Traditional Name: 2-(4-hydroxy-3-nitro-phenyl)-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]acetamide Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5/c25-16-7-6-12(10-15(16)24(28)29)11-17(26)20-8-3-9-21-18-13-4-1-2-5-14(13)19(27)23-22-18/h1-2,4-7,10,25H,3,8-9,11H2,(H,20,26)(H,21,22)(H,23,27)