4-bromanyl-3,5-bis(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole

Systemtic Name: 4-bromanyl-3,5-bis(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole Openeye Name: 1-benzyl-4-bromo-3,5-bis(3,4-dimethoxyphenyl)pyrazole CAS Name: 4-bromo-3,5-bis(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole IUPAC Name: 1-benzyl-4-bromo-3,5-bis(3,4-dimethoxyphenyl)pyrazole Traditional Name: 1-benzyl-4-bromo-3,5-bis(3,4-dimethoxyphenyl)pyrazole Formula: C26H25BrN2O4 MolecularWeight: 509.3917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)Br)OC

InChI

InChI=1S/C26H25BrN2O4/c1-30-20-12-10-18(14-22(20)32-3)25-24(27)26(19-11-13-21(31-2)23(15-19)33-4)29(28-25)16-17-8-6-5-7-9-17/h5-15H,16H2,1-4H3