2-(3,4-dichlorophenyl)-4-(4-oxidanyl-4-phenyl-piperidin-1-yl)-1-(4-phenylpyrazol-1-yl)butan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)O)CCC(C3=CC(=C(C=C3)Cl)Cl)C(=O)N4C=C(C=N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)O)CCC(C3=CC(=C(C=C3)Cl)Cl)C(=O)N4C=C(C=N4)C5=CC=CC=C5

InChI

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