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

Systemtic Name: 4-chloranyl-3,5-bis(3,4-dimethoxyphenyl)-1-[(3-nitrophenyl)methyl]pyrazole Openeye Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-[(3-nitrophenyl)methyl]pyrazole CAS Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-[(3-nitrophenyl)methyl]pyrazole IUPAC Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-[(3-nitrophenyl)methyl]pyrazole Traditional Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-(3-nitrobenzyl)pyrazole Formula: C26H24ClN3O6 MolecularWeight: 509.93826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC)Cl)OC

InChI

InChI=1S/C26H24ClN3O6/c1-33-20-10-8-17(13-22(20)35-3)25-24(27)26(18-9-11-21(34-2)23(14-18)36-4)29(28-25)15-16-6-5-7-19(12-16)30(31)32/h5-14H,15H2,1-4H3