(2S,7aR)-2-(4-bromophenyl)-7a-methyl-1-oxidanyl-4,5,6,7-tetrahydro-2H-benzimidazole

Systemtic Name: (2S,7aR)-2-(4-bromophenyl)-7a-methyl-1-oxidanyl-4,5,6,7-tetrahydro-2H-benzimidazole Openeye Name: (2S,7aR)-2-(4-bromophenyl)-1-hydroxy-7a-methyl-4,5,6,7-tetrahydro-2H-benzimidazole CAS Name: (2S,7aR)-2-(4-bromophenyl)-1-hydroxy-7a-methyl-4,5,6,7-tetrahydro-2H-benzimidazole IUPAC Name: (2S,7aR)-2-(4-bromophenyl)-1-hydroxy-7a-methyl-4,5,6,7-tetrahydro-2H-benzimidazole Traditional Name: (2S,7aR)-2-(4-bromophenyl)-1-hydroxy-7a-methyl-4,5,6,7-tetrahydro-2H-benzimidazole Formula: C14H17BrN2O MolecularWeight: 309.20158

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCCC1=NC(N2O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@]12CCCCC1=N[C@@H](N2O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C14H17BrN2O/c1-14-9-3-2-4-12(14)16-13(17(14)18)10-5-7-11(15)8-6-10/h5-8,13,18H,2-4,9H2,1H3/t13-,14+/m0/s1