2-[4-[2-[2-(1-ethyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]ethyl]piperazin-1-yl]ethyl ethanoate

Systemtic Name: 2-[4-[2-[2-(1-ethyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]ethyl]piperazin-1-yl]ethyl ethanoate Openeye Name: 2-[4-[2-[2-(1-ethyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]ethyl]piperazin-1-yl]ethyl acetate CAS Name: acetic acid 2-[4-[2-[2-(1-ethyl-5-nitro-2-imidazolyl)-1-benzimidazolyl]ethyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[2-[2-(1-ethyl-5-nitroimidazol-2-yl)benzimidazol-1-yl]ethyl]piperazin-1-yl]ethyl acetate Traditional Name: acetic acid 2-[4-[2-[2-(1-ethyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]ethyl]piperazino]ethyl ester Formula: C22H29N7O4 MolecularWeight: 455.51016

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1C2=NC3=CC=CC=C3N2CCN4CCN(CC4)CCOC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CN=C1C2=NC3=CC=CC=C3N2CCN4CCN(CC4)CCOC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H29N7O4/c1-3-27-20(29(31)32)16-23-21(27)22-24-18-6-4-5-7-19(18)28(22)13-12-25-8-10-26(11-9-25)14-15-33-17(2)30/h4-7,16H,3,8-15H2,1-2H3