N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-4-[(4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-3-yl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide Formula: C21H17ClN6O3 MolecularWeight: 436.85108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=N2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H17ClN6O3/c22-19-4-2-1-3-17(19)13-26-10-9-20(25-26)24-21(29)16-7-5-15(6-8-16)12-27-14-18(11-23-27)28(30)31/h1-11,14H,12-13H2,(H,24,25,29)