methyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(2-ethoxy-2-oxo-ethyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2-ethoxy-2-oxoethyl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(2-ethoxy-2-oxoethyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2-ethoxy-2-keto-ethyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C13H14N2O7 MolecularWeight: 310.25946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC(=O)CNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H14N2O7/c1-3-22-11(16)7-14-12(17)8-4-9(13(18)21-2)6-10(5-8)15(19)20/h4-6H,3,7H2,1-2H3,(H,14,17)