(4-bromophenyl)-[(4R,5S)-5-oxidanyl-2-phenyl-4-piperidin-1-yl-4,5-dihydroimidazol-1-yl]methanone

Systemtic Name: (4-bromophenyl)-[(4R,5S)-5-oxidanyl-2-phenyl-4-piperidin-1-yl-4,5-dihydroimidazol-1-yl]methanone Openeye Name: (4-bromophenyl)-[(4R,5S)-5-hydroxy-2-phenyl-4-(1-piperidyl)-4,5-dihydroimidazol-1-yl]methanone CAS Name: (4-bromophenyl)-[(4R,5S)-5-hydroxy-2-phenyl-4-(1-piperidinyl)-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: (4-bromophenyl)-[(4R,5S)-5-hydroxy-2-phenyl-4-piperidin-1-yl-4,5-dihydroimidazol-1-yl]methanone Traditional Name: (4-bromophenyl)-[(4R,5S)-5-hydroxy-2-phenyl-4-piperidino-2-imidazolin-1-yl]methanone Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2C(N(C(=N2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)O

Isomeric SMILES

C1CCN(CC1)[C@H]2[C@@H](N(C(=N2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)O

InChI

InChI=1S/C21H22BrN3O2/c22-17-11-9-16(10-12-17)20(26)25-18(15-7-3-1-4-8-15)23-19(21(25)27)24-13-5-2-6-14-24/h1,3-4,7-12,19,21,27H,2,5-6,13-14H2/t19-,21-/m0/s1