2-[2-[1-(1-acetyloxyethyl)-5-nitro-imidazol-2-yl]benzimidazol-1-yl]ethyl ethanoate

Systemtic Name: 2-[2-[1-(1-acetyloxyethyl)-5-nitro-imidazol-2-yl]benzimidazol-1-yl]ethyl ethanoate Openeye Name: 2-[2-[1-(1-acetoxyethyl)-5-nitro-imidazol-2-yl]benzimidazol-1-yl]ethyl acetate CAS Name: acetic acid 2-[2-[1-(1-acetyloxyethyl)-5-nitro-2-imidazolyl]-1-benzimidazolyl]ethyl ester IUPAC Name: 2-[2-[1-(1-acetyloxyethyl)-5-nitroimidazol-2-yl]benzimidazol-1-yl]ethyl acetate Traditional Name: acetic acid 2-[2-[1-(1-acetoxyethyl)-5-nitro-imidazol-2-yl]benzimidazol-1-yl]ethyl ester Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C(=CN=C1C2=NC3=CC=CC=C3N2CCOC(=O)C)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC(N1C(=CN=C1C2=NC3=CC=CC=C3N2CCOC(=O)C)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C18H19N5O6/c1-11(29-13(3)25)22-16(23(26)27)10-19-17(22)18-20-14-6-4-5-7-15(14)21(18)8-9-28-12(2)24/h4-7,10-11H,8-9H2,1-3H3