(2-azanyl-2-oxidanylidene-ethyl) 3-methyl-2-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-methyl-2-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C10H10N2O5 MolecularWeight: 238.1968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O5/c1-6-3-2-4-7(9(6)12(15)16)10(14)17-5-8(11)13/h2-4H,5H2,1H3,(H2,11,13)