4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(3-nitro-5-phenoxy-phenyl)butanamide

Systemtic Name: 4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(3-nitro-5-phenoxy-phenyl)butanamide Openeye Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-(3-nitro-5-phenoxy-phenyl)butanamide CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-(3-nitro-5-phenoxyphenyl)butanamide IUPAC Name: 4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-(3-nitro-5-phenoxyphenyl)butanamide Traditional Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-(3-nitro-5-phenoxy-phenyl)butyramide Formula: C20H18ClN5O6 MolecularWeight: 459.83982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C20H18ClN5O6/c1-13-19(21)20(26(30)31)23-24(13)9-5-8-18(27)22-14-10-15(25(28)29)12-17(11-14)32-16-6-3-2-4-7-16/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,22,27)