3-(6-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate

Systemtic Name: 3-(6-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate Openeye Name: 3-(6-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 3-(6-nitro-1H-benzimidazol-2-yl)propyl ester IUPAC Name: 3-(6-nitro-1H-benzimidazol-2-yl)propyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 3-(6-nitro-1H-benzimidazol-2-yl)propyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCCCC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)OCCCC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4/c21-17(12-5-2-1-3-6-12)24-10-4-7-16-18-14-9-8-13(20(22)23)11-15(14)19-16/h8-9,11-12H,1-7,10H2,(H,18,19)