(3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethylpiperazin-1-yl)piperidin-3-ol

Systemtic Name: (3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethylpiperazin-1-yl)piperidin-3-ol Openeye Name: (3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethylpiperazin-1-yl)piperidin-3-ol CAS Name: (3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethyl-1-piperazinyl)-3-piperidinol IUPAC Name: (3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethylpiperazin-1-yl)piperidin-3-ol Traditional Name: (3R,4R)-1-(1H-imidazol-5-ylmethyl)-4-(4-phenethylpiperazino)piperidin-3-ol Formula: C21H31N5O MolecularWeight: 369.50374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1N2CCN(CC2)CCC3=CC=CC=C3)O)CC4=CN=CN4

Isomeric SMILES

C1CN(C[C@H]([C@@H]1N2CCN(CC2)CCC3=CC=CC=C3)O)CC4=CN=CN4

InChI

InChI=1S/C21H31N5O/c27-21-16-25(15-19-14-22-17-23-19)9-7-20(21)26-12-10-24(11-13-26)8-6-18-4-2-1-3-5-18/h1-5,14,17,20-21,27H,6-13,15-16H2,(H,22,23)/t20-,21-/m1/s1