N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]-3-nitro-benzamide

Systemtic Name: N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]-3-nitro-benzamide Openeye Name: N-[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]isoindol-1-ylidene]-3-nitro-benzamide CAS Name: N-[3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-1-isoindolylidene]-3-nitrobenzamide IUPAC Name: N-[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]isoindol-1-ylidene]-3-nitrobenzamide Traditional Name: N-[3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]isoindol-1-ylidene]-3-nitro-benzamide Formula: C26H20N6O4 MolecularWeight: 480.4748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC(=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C53

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC(=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C53

InChI

InChI=1S/C26H20N6O4/c1-16-22(26(34)31(30(16)2)18-10-4-3-5-11-18)27-23-20-13-6-7-14-21(20)24(28-23)29-25(33)17-9-8-12-19(15-17)32(35)36/h3-15H,1-2H3,(H,27,28,29,33)