(3aS)-3a-methyl-2-(4-nitrophenyl)-3-oxidanyl-5,6-dihydro-4H-benzimidazole

Systemtic Name: (3aS)-3a-methyl-2-(4-nitrophenyl)-3-oxidanyl-5,6-dihydro-4H-benzimidazole Openeye Name: (3aS)-3-hydroxy-3a-methyl-2-(4-nitrophenyl)-5,6-dihydro-4H-benzimidazole CAS Name: (3aS)-3-hydroxy-3a-methyl-2-(4-nitrophenyl)-5,6-dihydro-4H-benzimidazole IUPAC Name: (3aS)-3-hydroxy-3a-methyl-2-(4-nitrophenyl)-5,6-dihydro-4H-benzimidazole Traditional Name: (3aS)-3-hydroxy-3a-methyl-2-(4-nitrophenyl)-5,6-dihydro-4H-benzimidazole Formula: C14H15N3O3 MolecularWeight: 273.2872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC=C1N=C(N2O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@]12CCCC=C1N=C(N2O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3/c1-14-9-3-2-4-12(14)15-13(16(14)18)10-5-7-11(8-6-10)17(19)20/h4-8,18H,2-3,9H2,1H3/t14-/m0/s1