[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 2-azanyl-4-nitro-benzoate

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 2-azanyl-4-nitro-benzoate Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 2-amino-4-nitro-benzoate CAS Name: 2-amino-4-nitrobenzoic acid [4-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl ester IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 2-amino-4-nitrobenzoate Traditional Name: 2-amino-4-nitro-benzoic acid [4-(3,5-dimethylpyrazol-1-yl)benzyl] ester Formula: C19H18N4O4 MolecularWeight: 366.37062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])N)C

InChI

InChI=1S/C19H18N4O4/c1-12-9-13(2)22(21-12)15-5-3-14(4-6-15)11-27-19(24)17-8-7-16(23(25)26)10-18(17)20/h3-10H,11,20H2,1-2H3