N-[1-[1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidin-4-yl]-2-phenyl-ethyl]-N,1-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[1-[1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidin-4-yl]-2-phenyl-ethyl]-N,1-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[1-[1-[(5-chloro-2-hydroxy-phenyl)methyl]-4-piperidyl]-2-phenyl-ethyl]-N,1-dimethyl-pyrazole-3-carboxamide CAS Name: N-[1-[1-[(5-chloro-2-hydroxyphenyl)methyl]-4-piperidinyl]-2-phenylethyl]-N,1-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[1-[1-[(5-chloro-2-hydroxyphenyl)methyl]piperidin-4-yl]-2-phenylethyl]-N,1-dimethylpyrazole-3-carboxamide Traditional Name: N-[1-[1-(5-chloro-2-hydroxy-benzyl)-4-piperidyl]-2-phenyl-ethyl]-N,1-dimethyl-pyrazole-3-carboxamide Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)N(C)C(CC2=CC=CC=C2)C3CCN(CC3)CC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

CN1C=CC(=N1)C(=O)N(C)C(CC2=CC=CC=C2)C3CCN(CC3)CC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C26H31ClN4O2/c1-29-13-12-23(28-29)26(33)30(2)24(16-19-6-4-3-5-7-19)20-10-14-31(15-11-20)18-21-17-22(27)8-9-25(21)32/h3-9,12-13,17,20,24,32H,10-11,14-16,18H2,1-2H3