ethyl 3-nitro-4-(4-oxidanylpiperidin-1-yl)benzoate

Systemtic Name: ethyl 3-nitro-4-(4-oxidanylpiperidin-1-yl)benzoate Openeye Name: ethyl 4-(4-hydroxy-1-piperidyl)-3-nitro-benzoate CAS Name: 4-(4-hydroxy-1-piperidinyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(4-hydroxypiperidin-1-yl)-3-nitrobenzoate Traditional Name: 4-(4-hydroxypiperidino)-3-nitro-benzoic acid ethyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCC(CC2)O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCC(CC2)O)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-2-21-14(18)10-3-4-12(13(9-10)16(19)20)15-7-5-11(17)6-8-15/h3-4,9,11,17H,2,5-8H2,1H3