4-bromanyl-3,5-bis(3,4-dimethylphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole

Systemtic Name: 4-bromanyl-3,5-bis(3,4-dimethylphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole Openeye Name: 4-bromo-3,5-bis(3,4-dimethylphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole CAS Name: 4-bromo-3,5-bis(3,4-dimethylphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole IUPAC Name: 4-bromo-3,5-bis(3,4-dimethylphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole Traditional Name: 4-bromo-3,5-bis(3,4-dimethylphenyl)-1-m-anisyl-pyrazole Formula: C27H27BrN2O MolecularWeight: 475.42008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)OC)C4=CC(=C(C=C4)C)C)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC(=CC=C3)OC)C4=CC(=C(C=C4)C)C)Br)C

InChI

InChI=1S/C27H27BrN2O/c1-17-9-11-22(13-19(17)3)26-25(28)27(23-12-10-18(2)20(4)14-23)30(29-26)16-21-7-6-8-24(15-21)31-5/h6-15H,16H2,1-5H3