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

Systemtic Name: methyl 3-[(2-methoxy-2-oxidanylidene-ethyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(2-methoxy-2-oxo-ethyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2-methoxy-2-oxoethyl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(2-methoxy-2-oxoethyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2-keto-2-methoxy-ethyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C12H12N2O7 MolecularWeight: 296.23288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O7/c1-20-10(15)6-13-11(16)7-3-8(12(17)21-2)5-9(4-7)14(18)19/h3-5H,6H2,1-2H3,(H,13,16)