2-(3,4-dichlorophenyl)-4-(4-oxidanyl-4-phenyl-piperidin-1-yl)-1-(5-phenyl-1H-pyrazol-4-yl)butan-1-one

Systemtic Name: 2-(3,4-dichlorophenyl)-4-(4-oxidanyl-4-phenyl-piperidin-1-yl)-1-(5-phenyl-1H-pyrazol-4-yl)butan-1-one Openeye Name: 2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenyl-1-piperidyl)-1-(5-phenyl-1H-pyrazol-4-yl)butan-1-one CAS Name: 2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenyl-1-piperidinyl)-1-(5-phenyl-1H-pyrazol-4-yl)-1-butanone IUPAC Name: 2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)-1-(5-phenyl-1H-pyrazol-4-yl)butan-1-one Traditional Name: 2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenyl-piperidino)-1-(5-phenyl-1H-pyrazol-4-yl)butan-1-one Formula: C30H29Cl2N3O2 MolecularWeight: 534.47616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)O)CCC(C3=CC(=C(C=C3)Cl)Cl)C(=O)C4=C(NN=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)O)CCC(C3=CC(=C(C=C3)Cl)Cl)C(=O)C4=C(NN=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H29Cl2N3O2/c31-26-12-11-22(19-27(26)32)24(29(36)25-20-33-34-28(25)21-7-3-1-4-8-21)13-16-35-17-14-30(37,15-18-35)23-9-5-2-6-10-23/h1-12,19-20,24,37H,13-18H2,(H,33,34)