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1H-benzimidazol-2-ylmethyl 4-nitrobenzoate

1H-benzimidazol-2-ylmethyl 4-nitrobenzoate

Systemtic Name:1H-benzimidazol-2-ylmethyl 4-nitrobenzoate
Openeye Name:1H-benzimidazol-2-ylmethyl 4-nitrobenzoate
CAS Name:4-nitrobenzoic acid 1H-benzimidazol-2-ylmethyl ester
IUPAC Name:1H-benzimidazol-2-ylmethyl 4-nitrobenzoate
Traditional Name:4-nitrobenzoic acid 1H-benzimidazol-2-ylmethyl ester
Formula: C15H11N3O4
MolecularWeight: 297.26554
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H11N3O4/c19-15(10-5-7-11(8-6-10)18(20)21)22-9-14-16-12-3-1-2-4-13(12)17-14/h1-8H,9H2,(H,16,17)


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