(4-nitrophenyl)methyl 3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: (4-nitrophenyl)methyl 3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: (4-nitrophenyl)methyl 3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[3-(3-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[3-(3-chlorophenyl)-1-phenyl-pyrazol-4-yl]acrylic acid (4-nitrobenzyl) ester Formula: C25H18ClN3O4 MolecularWeight: 459.88112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Cl)C=CC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Cl)C=CC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H18ClN3O4/c26-21-6-4-5-19(15-21)25-20(16-28(27-25)22-7-2-1-3-8-22)11-14-24(30)33-17-18-9-12-23(13-10-18)29(31)32/h1-16H,17H2