2-[3-bromanyl-4-[[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]methyl]phenoxy]ethanol

Systemtic Name: 2-[3-bromanyl-4-[[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]methyl]phenoxy]ethanol Openeye Name: 2-[3-bromo-4-[[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]methyl]phenoxy]ethanol CAS Name: 2-[3-bromo-4-[[[2-(1-pyrazolylmethyl)phenyl]methylamino]methyl]phenoxy]ethanol IUPAC Name: 2-[3-bromo-4-[[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]methyl]phenoxy]ethanol Traditional Name: 2-[3-bromo-4-[[[2-(pyrazol-1-ylmethyl)benzyl]amino]methyl]phenoxy]ethanol Formula: C20H22BrN3O2 MolecularWeight: 416.31158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCC2=C(C=C(C=C2)OCCO)Br)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)CNCC2=C(C=C(C=C2)OCCO)Br)CN3C=CC=N3

InChI

InChI=1S/C20H22BrN3O2/c21-20-12-19(26-11-10-25)7-6-17(20)14-22-13-16-4-1-2-5-18(16)15-24-9-3-8-23-24/h1-9,12,22,25H,10-11,13-15H2