methyl 3-(1-hydroxyethyl)-5-nitro-benzoate

Systemtic Name: methyl 3-(1-hydroxyethyl)-5-nitro-benzoate Openeye Name: methyl 3-(1-hydroxyethyl)-5-nitro-benzoate CAS Name: 3-(1-hydroxyethyl)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-(1-hydroxyethyl)-5-nitrobenzoate Traditional Name: 3-(1-hydroxyethyl)-5-nitro-benzoic acid methyl ester Formula: C10H11NO5 MolecularWeight: 225.19804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO5/c1-6(12)7-3-8(10(13)16-2)5-9(4-7)11(14)15/h3-6,12H,1-2H3