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5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid

5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid

Systemtic Name:5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid
Openeye Name:5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid
CAS Name:5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid
IUPAC Name:5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid
Traditional Name:5-(4-nitrophenyl)-2H-benzotriazole-4-carboxylic acid
Formula: C13H8N4O4
MolecularWeight: 284.22702
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C3=NNN=C3C=C2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1C2=C(C3=NNN=C3C=C2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C13H8N4O4/c18-13(19)11-9(5-6-10-12(11)15-16-14-10)7-1-3-8(4-2-7)17(20)21/h1-6H,(H,18,19)(H,14,15,16)


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