[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl] 2-chloranyl-4-nitro-benzoate Openeye Name: [2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-(4-methoxyphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methoxyphenyl)-5-phenylpyrazol-3-yl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C23H16ClN3O5 MolecularWeight: 449.84324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H16ClN3O5/c1-31-18-10-7-16(8-11-18)26-22(14-21(25-26)15-5-3-2-4-6-15)32-23(28)19-12-9-17(27(29)30)13-20(19)24/h2-14H,1H3