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2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid

2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid

Systemtic Name:2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid
Openeye Name:2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid
CAS Name:2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid
IUPAC Name:2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propanoic acid
Traditional Name:2-methyl-3-[(4-nitro-1H-benzimidazol-2-yl)sulfonylamino]propionic acid
Formula: C11H12N4O6S
MolecularWeight: 328.30118
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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=NC2=C(N1)C=CC=C2[N+](=O)[O-])C(=O)O


Isomeric SMILES

CC(CNS(=O)(=O)C1=NC2=C(N1)C=CC=C2[N+](=O)[O-])C(=O)O


InChI

InChI=1S/C11H12N4O6S/c1-6(10(16)17)5-12-22(20,21)11-13-7-3-2-4-8(15(18)19)9(7)14-11/h2-4,6,12H,5H2,1H3,(H,13,14)(H,16,17)


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