2-[3-(1-methyl-5-nitro-imidazol-2-yl)-2-(phenylmethyl)-1,2-oxazolidin-5-yl]ethanoic acid

Systemtic Name: 2-[3-(1-methyl-5-nitro-imidazol-2-yl)-2-(phenylmethyl)-1,2-oxazolidin-5-yl]ethanoic acid Openeye Name: 2-[2-benzyl-3-(1-methyl-5-nitro-imidazol-2-yl)isoxazolidin-5-yl]acetic acid CAS Name: 2-[3-(1-methyl-5-nitro-2-imidazolyl)-2-(phenylmethyl)-5-isoxazolidinyl]acetic acid IUPAC Name: 2-[2-benzyl-3-(1-methyl-5-nitroimidazol-2-yl)-1,2-oxazolidin-5-yl]acetic acid Traditional Name: 2-[2-benzyl-3-(1-methyl-5-nitro-imidazol-2-yl)isoxazolidin-5-yl]acetic acid Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C2CC(ON2CC3=CC=CC=C3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C2CC(ON2CC3=CC=CC=C3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5/c1-18-14(20(23)24)9-17-16(18)13-7-12(8-15(21)22)25-19(13)10-11-5-3-2-4-6-11/h2-6,9,12-13H,7-8,10H2,1H3,(H,21,22)