[2-(ethylamino)-2-oxidanylidene-ethyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [2-(ethylamino)-2-oxidanylidene-ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-(ethylamino)-2-oxo-ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-(ethylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylamino)-2-oxoethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-(ethylamino)-2-keto-ethyl] ester Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCNC(=O)COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C12H14N2O5/c1-3-13-11(15)7-19-12(16)9-4-5-10(14(17)18)8(2)6-9/h4-6H,3,7H2,1-2H3,(H,13,15)