N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H17ClN6O4 MolecularWeight: 452.85048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])Cl

InChI

InChI=1S/C21H17ClN6O4/c22-17-6-2-1-5-15(17)12-27-13-16(11-23-27)24-21(29)18-9-10-26(25-18)14-32-20-8-4-3-7-19(20)28(30)31/h1-11,13H,12,14H2,(H,24,29)