prop-2-enyl 3-[methyl(oxidanyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: prop-2-enyl 3-[methyl(oxidanyl)carbamoyl]-5-nitro-benzoate Openeye Name: allyl 3-[hydroxy(methyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[hydroxy(methyl)amino]-oxomethyl]-5-nitrobenzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-[hydroxy(methyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[hydroxy(methyl)carbamoyl]-5-nitro-benzoic acid allyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6/c1-3-4-20-12(16)9-5-8(11(15)13(2)17)6-10(7-9)14(18)19/h3,5-7,17H,1,4H2,2H3