2-(4-ethoxycarbonylpiperidin-1-yl)-5-nitro-benzoic acid

Systemtic Name: 2-(4-ethoxycarbonylpiperidin-1-yl)-5-nitro-benzoic acid Openeye Name: 2-(4-ethoxycarbonyl-1-piperidyl)-5-nitro-benzoic acid CAS Name: 2-(4-ethoxycarbonyl-1-piperidinyl)-5-nitrobenzoic acid IUPAC Name: 2-(4-ethoxycarbonylpiperidin-1-yl)-5-nitrobenzoic acid Traditional Name: 2-(4-carbethoxypiperidino)-5-nitro-benzoic acid Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H18N2O6/c1-2-23-15(20)10-5-7-16(8-6-10)13-4-3-11(17(21)22)9-12(13)14(18)19/h3-4,9-10H,2,5-8H2,1H3,(H,18,19)