methyl 4-[2-(cyclopropylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(cyclopropylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(cyclopropylamino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(cyclopropylamino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(cyclopropylamino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(cyclopropylamino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2CC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c1-20-13(17)8-2-5-11(10(6-8)15(18)19)21-7-12(16)14-9-3-4-9/h2,5-6,9H,3-4,7H2,1H3,(H,14,16)