N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-methyl-2-nitro-phenoxy)methyl]benzamide

Systemtic Name: N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-methyl-2-nitro-phenoxy)methyl]benzamide Openeye Name: N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-methyl-2-nitro-phenoxy)methyl]benzamide CAS Name: N-[1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-3-[(4-methyl-2-nitrophenoxy)methyl]benzamide IUPAC Name: N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-methyl-2-nitrophenoxy)methyl]benzamide Traditional Name: N-[1-(4-fluorobenzyl)pyrazol-3-yl]-3-[(4-methyl-2-nitro-phenoxy)methyl]benzamide Formula: C25H21FN4O4 MolecularWeight: 460.457043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C25H21FN4O4/c1-17-5-10-23(22(13-17)30(32)33)34-16-19-3-2-4-20(14-19)25(31)27-24-11-12-29(28-24)15-18-6-8-21(26)9-7-18/h2-14H,15-16H2,1H3,(H,27,28,31)