4-[[4-[2-[1-(4-pyrazol-1-ylphenyl)carbonylpiperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[4-[2-[1-(4-pyrazol-1-ylphenyl)carbonylpiperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde Openeye Name: 4-[[4-[2-[1-(4-pyrazol-1-ylbenzoyl)-2-piperidyl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-[2-[1-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-2-piperidinyl]ethoxy]phenyl]methyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[[4-[2-[1-(4-pyrazol-1-ylbenzoyl)piperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[2-[1-(4-pyrazol-1-ylbenzoyl)-2-piperidyl]ethoxy]benzyl]piperazine-1-carbaldehyde Formula: C29H35N5O3 MolecularWeight: 501.6199

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCOC2=CC=C(C=C2)CN3CCN(CC3)C=O)C(=O)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1CCN(C(C1)CCOC2=CC=C(C=C2)CN3CCN(CC3)C=O)C(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C29H35N5O3/c35-23-32-19-17-31(18-20-32)22-24-5-11-28(12-6-24)37-21-13-26-4-1-2-15-33(26)29(36)25-7-9-27(10-8-25)34-16-3-14-30-34/h3,5-12,14,16,23,26H,1-2,4,13,15,17-22H2