(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-nitrophenoxy)ethanoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-nitrophenoxy)ethanoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C19H16ClN3O5 MolecularWeight: 401.80044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)COC2=CC=CC=C2[N+](=O)[O-])Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)COC2=CC=CC=C2[N+](=O)[O-])Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H16ClN3O5/c1-13-15(19(20)22(21-13)14-7-3-2-4-8-14)11-28-18(24)12-27-17-10-6-5-9-16(17)23(25)26/h2-10H,11-12H2,1H3