1-[(4-chlorophenyl)methyl]-3-[(4,4-diphenylpiperidin-1-yl)methyl]pyrazole-4-carbaldehyde

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(4,4-diphenylpiperidin-1-yl)methyl]pyrazole-4-carbaldehyde Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(4,4-diphenyl-1-piperidyl)methyl]pyrazole-4-carbaldehyde CAS Name: 1-[(4-chlorophenyl)methyl]-3-[(4,4-diphenyl-1-piperidinyl)methyl]-4-pyrazolecarboxaldehyde IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(4,4-diphenylpiperidin-1-yl)methyl]pyrazole-4-carbaldehyde Traditional Name: 1-(4-chlorobenzyl)-3-[(4,4-diphenylpiperidino)methyl]pyrazole-4-carbaldehyde Formula: C29H28ClN3O MolecularWeight: 470.00512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C3=CC=CC=C3)CC4=NN(C=C4C=O)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C3=CC=CC=C3)CC4=NN(C=C4C=O)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H28ClN3O/c30-27-13-11-23(12-14-27)19-33-20-24(22-34)28(31-33)21-32-17-15-29(16-18-32,25-7-3-1-4-8-25)26-9-5-2-6-10-26/h1-14,20,22H,15-19,21H2