[2-oxidanylidene-2-(propylamino)ethyl] 4-ethoxy-5-methoxy-2-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 4-ethoxy-5-methoxy-2-nitro-benzoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 4-ethoxy-5-methoxy-2-nitro-benzoate CAS Name: 4-ethoxy-5-methoxy-2-nitrobenzoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 4-ethoxy-5-methoxy-2-nitrobenzoate Traditional Name: 4-ethoxy-5-methoxy-2-nitro-benzoic acid [2-keto-2-(propylamino)ethyl] ester Formula: C15H20N2O7 MolecularWeight: 340.3285

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCC)OC

Isomeric SMILES

CCCNC(=O)COC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCC)OC

InChI

InChI=1S/C15H20N2O7/c1-4-6-16-14(18)9-24-15(19)10-7-12(22-3)13(23-5-2)8-11(10)17(20)21/h7-8H,4-6,9H2,1-3H3,(H,16,18)