2-[(E)-2-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)ethenyl]-5-nitro-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)ethenyl]-5-nitro-1,3-benzoxazole Openeye Name: 2-[(E)-2-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)vinyl]-5-nitro-1,3-benzoxazole CAS Name: 2-[(E)-2-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)ethenyl]-5-nitro-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)ethenyl]-5-nitro-1,3-benzoxazole Traditional Name: 2-[(E)-2-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)vinyl]-5-nitro-1,3-benzoxazole Formula: C19H13ClN4O3 MolecularWeight: 380.78452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H13ClN4O3/c1-12-15(19(20)23(22-12)13-5-3-2-4-6-13)8-10-18-21-16-11-14(24(25)26)7-9-17(16)27-18/h2-11H,1H3/b10-8+