(4-nitrophenyl) N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)phenyl]carbamate

Systemtic Name: (4-nitrophenyl) N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)phenyl]carbamate Openeye Name: (4-nitrophenyl) N-[3-(4-bromo-2-methyl-pyrazol-3-yl)phenyl]carbamate CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)phenyl]carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[3-(4-bromo-2-methylpyrazol-3-yl)phenyl]carbamate Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)phenyl]carbamic acid (4-nitrophenyl) ester Formula: C17H13BrN4O4 MolecularWeight: 417.21352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=CC(=CC=C2)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=CC(=CC=C2)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13BrN4O4/c1-21-16(15(18)10-19-21)11-3-2-4-12(9-11)20-17(23)26-14-7-5-13(6-8-14)22(24)25/h2-10H,1H3,(H,20,23)