ethyl 4-(1-hydroxyethyl)-3-nitro-benzoate

Systemtic Name: ethyl 4-(1-hydroxyethyl)-3-nitro-benzoate Openeye Name: ethyl 4-(1-hydroxyethyl)-3-nitro-benzoate CAS Name: 4-(1-hydroxyethyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(1-hydroxyethyl)-3-nitrobenzoate Traditional Name: 4-(1-hydroxyethyl)-3-nitro-benzoic acid ethyl ester Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5/c1-3-17-11(14)8-4-5-9(7(2)13)10(6-8)12(15)16/h4-7,13H,3H2,1-2H3