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

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[1-(4-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)[N+](=O)[O-])OCN2C=CC(=N2)C(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OCN2C=CC(=N2)C(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Cl

InChI

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