N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C20H17N5O4 MolecularWeight: 391.38008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O4/c1-12-19(25(27)28)13(2)24(23-12)11-18(26)21-15-9-7-14(8-10-15)20-22-16-5-3-4-6-17(16)29-20/h3-10H,11H2,1-2H3,(H,21,26)