2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]phenol

Systemtic Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]phenol Openeye Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]phenol CAS Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]-1-piperazinyl]phenol IUPAC Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]phenol Traditional Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazino]phenol Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5O

InChI

InChI=1S/C27H28N4O2/c1-29-19-22(20-30-15-17-31(18-16-30)25-9-5-6-10-26(25)32)27(28-29)21-11-13-24(14-12-21)33-23-7-3-2-4-8-23/h2-14,19,32H,15-18,20H2,1H3