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

Systemtic Name: 4-chloranyl-3,5-bis(3,4-dimethylphenyl)-1-[(3-nitrophenyl)methyl]pyrazole Openeye Name: 4-chloro-3,5-bis(3,4-dimethylphenyl)-1-[(3-nitrophenyl)methyl]pyrazole CAS Name: 4-chloro-3,5-bis(3,4-dimethylphenyl)-1-[(3-nitrophenyl)methyl]pyrazole IUPAC Name: 4-chloro-3,5-bis(3,4-dimethylphenyl)-1-[(3-nitrophenyl)methyl]pyrazole Traditional Name: 4-chloro-3,5-bis(3,4-dimethylphenyl)-1-(3-nitrobenzyl)pyrazole Formula: C26H24ClN3O2 MolecularWeight: 445.94066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C)Cl)C

InChI

InChI=1S/C26H24ClN3O2/c1-16-8-10-21(12-18(16)3)25-24(27)26(22-11-9-17(2)19(4)13-22)29(28-25)15-20-6-5-7-23(14-20)30(31)32/h5-14H,15H2,1-4H3