[(3S)-2-oxidanylideneoxolan-3-yl] 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-[(3-methyl-4-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]acetic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)amino]acetic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C14H14N2O7 MolecularWeight: 322.27016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(=O)OC2CCOC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(=O)O[C@H]2CCOC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O7/c1-8-6-9(2-3-10(8)16(20)21)13(18)15-7-12(17)23-11-4-5-22-14(11)19/h2-3,6,11H,4-5,7H2,1H3,(H,15,18)/t11-/m0/s1