4-chloranyl-3,5-bis(2-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrazole

Systemtic Name: 4-chloranyl-3,5-bis(2-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrazole Openeye Name: 4-chloro-3,5-bis(2-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrazole CAS Name: 4-chloro-3,5-bis(2-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrazole IUPAC Name: 4-chloro-3,5-bis(2-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrazole Traditional Name: 4-chloro-3,5-bis(2-methoxyphenyl)-1-(4-nitrobenzyl)pyrazole Formula: C24H20ClN3O4 MolecularWeight: 449.8863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(C(=NN2CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4OC)Cl

Isomeric SMILES

COC1=CC=CC=C1C2=C(C(=NN2CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4OC)Cl

InChI

InChI=1S/C24H20ClN3O4/c1-31-20-9-5-3-7-18(20)23-22(25)24(19-8-4-6-10-21(19)32-2)27(26-23)15-16-11-13-17(14-12-16)28(29)30/h3-14H,15H2,1-2H3