5-bromanyl-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanidyl-pyrazol-2-ium

Systemtic Name: 5-bromanyl-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanidyl-pyrazol-2-ium Openeye Name: 5-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxido-pyrazol-2-ium CAS Name: 5-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxidopyrazol-2-ium IUPAC Name: 5-bromo-3-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-2-oxidopyrazol-2-ium Traditional Name: 3-bromo-5-(4-methoxyphenyl)-1-oxido-2-p-anisyl-pyrazol-1-ium Formula: C18H17BrN2O3 MolecularWeight: 389.24318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=CC(=[N+]2[O-])C3=CC=C(C=C3)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=CC(=[N+]2[O-])C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C18H17BrN2O3/c1-23-15-7-3-13(4-8-15)12-20-18(19)11-17(21(20)22)14-5-9-16(24-2)10-6-14/h3-11H,12H2,1-2H3