[2-(ethylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(ethylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-(ethylamino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(ethylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylamino)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(ethylamino)-2-keto-ethyl] ester Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-2-12-10(14)7-18-11(15)8-4-3-5-9(6-8)13(16)17/h3-6H,2,7H2,1H3,(H,12,14)