4-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-2-nitro-phenolate

Systemtic Name: 4-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-2-nitro-phenolate Openeye Name: 4-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-2-nitro-phenolate CAS Name: 4-[(4-ethoxycarbonyl-1-piperidin-1-iumyl)methyl]-2-nitrophenolate IUPAC Name: 4-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-2-nitrophenolate Traditional Name: 4-[(4-carbethoxypiperidin-1-ium-1-yl)methyl]-2-nitro-phenolate Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O5/c1-2-22-15(19)12-5-7-16(8-6-12)10-11-3-4-14(18)13(9-11)17(20)21/h3-4,9,12,18H,2,5-8,10H2,1H3