1H-benzimidazol-2-ylmethyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: 1H-benzimidazol-2-ylmethyl 2-chloranyl-5-nitro-benzoate Openeye Name: 1H-benzimidazol-2-ylmethyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid 1H-benzimidazol-2-ylmethyl ester IUPAC Name: 1H-benzimidazol-2-ylmethyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid 1H-benzimidazol-2-ylmethyl ester Formula: C15H10ClN3O4 MolecularWeight: 331.7106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10ClN3O4/c16-11-6-5-9(19(21)22)7-10(11)15(20)23-8-14-17-12-3-1-2-4-13(12)18-14/h1-7H,8H2,(H,17,18)