N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitro-benzamide Openeye Name: N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitro-benzamide CAS Name: N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitrobenzamide IUPAC Name: N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitrobenzamide Traditional Name: N-[3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-4-nitro-benzamide Formula: C23H16N6O3 MolecularWeight: 424.41154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=NN=C2C3=CC=CC=C13)C4=CC(=CC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=NN2C(=NN=C2C3=CC=CC=C13)C4=CC(=CC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N6O3/c1-14-19-7-2-3-8-20(19)22-26-25-21(28(22)27-14)16-5-4-6-17(13-16)24-23(30)15-9-11-18(12-10-15)29(31)32/h2-13H,1H3,(H,24,30)