N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C15H12BrClN6O4 MolecularWeight: 455.65058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

InChI

InChI=1S/C15H12BrClN6O4/c1-27-15-12(23(25)26)11(19-20-15)14(24)18-13-9(16)7-22(21-13)6-8-4-2-3-5-10(8)17/h2-5,7H,6H2,1H3,(H,19,20)(H,18,21,24)