N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-N-pentyl-benzamide

Systemtic Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-N-pentyl-benzamide Openeye Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-4-methyl-3-nitro-N-pentyl-benzamide CAS Name: N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-4-methyl-3-nitro-N-pentylbenzamide IUPAC Name: N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-4-methyl-3-nitro-N-pentylbenzamide Traditional Name: N-amyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C30H30FN5O4 MolecularWeight: 543.588703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C30H30FN5O4/c1-3-4-8-17-34(30(38)23-12-11-21(2)27(18-23)36(39)40)20-29(37)32-28-19-26(22-9-6-5-7-10-22)33-35(28)25-15-13-24(31)14-16-25/h5-7,9-16,18-19H,3-4,8,17,20H2,1-2H3,(H,32,37)