tert-butyl N-[[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]methyl]carbamate CAS Name: N-[[4-(1-hydroxy-6-nitro-2-benzimidazolyl)phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]methyl]carbamate Traditional Name: N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)benzyl]carbamic acid tert-butyl ester Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5/c1-19(2,3)28-18(24)20-11-12-4-6-13(7-5-12)17-21-15-9-8-14(23(26)27)10-16(15)22(17)25/h4-10,25H,11H2,1-3H3,(H,20,24)