2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-2-(pyridin-3-ylcarbonylamino)ethanoic acid

Systemtic Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-2-(pyridin-3-ylcarbonylamino)ethanoic acid Openeye Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-2-(pyridine-3-carbonylamino)acetic acid CAS Name: 2-[2-(2-methyl-5-nitro-1-imidazolyl)ethoxy]-2-[[oxo(3-pyridinyl)methyl]amino]acetic acid IUPAC Name: 2-[2-(2-methyl-5-nitroimidazol-1-yl)ethoxy]-2-(pyridine-3-carbonylamino)acetic acid Traditional Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]-2-nicotinamido-acetic acid Formula: C14H15N5O6 MolecularWeight: 349.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(C(=O)O)NC(=O)C2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(C(=O)O)NC(=O)C2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O6/c1-9-16-8-11(19(23)24)18(9)5-6-25-13(14(21)22)17-12(20)10-3-2-4-15-7-10/h2-4,7-8,13H,5-6H2,1H3,(H,17,20)(H,21,22)