N-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-1-(2-heptoxyphenyl)methanimine

Systemtic Name: N-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-1-(2-heptoxyphenyl)methanimine Openeye Name: N-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-1-(2-heptoxyphenyl)methanimine CAS Name: N-[5-(4-chlorophenyl)-2-phenyl-3-pyrazolyl]-1-(2-heptoxyphenyl)methanimine IUPAC Name: N-[5-(4-chlorophenyl)-2-phenylpyrazol-3-yl]-1-(2-heptoxyphenyl)methanimine Traditional Name: (E)-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-(2-heptoxybenzylidene)amine Formula: C29H30ClN3O MolecularWeight: 472.021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1C=NC2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1/C=N/C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H30ClN3O/c1-2-3-4-5-11-20-34-28-15-10-9-12-24(28)22-31-29-21-27(23-16-18-25(30)19-17-23)32-33(29)26-13-7-6-8-14-26/h6-10,12-19,21-22H,2-5,11,20H2,1H3/b31-22+