2-(1-methylpiperidin-1-ium-4-yl)oxycarbonylbenzoate

Systemtic Name: 2-(1-methylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Openeye Name: 2-(1-methylpiperidin-1-ium-4-yl)oxycarbonylbenzoate CAS Name: 2-[(1-methyl-4-piperidin-1-iumyl)oxy-oxomethyl]benzoate IUPAC Name: 2-(1-methylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Traditional Name: 2-(1-methylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H17NO4/c1-15-8-6-10(7-9-15)19-14(18)12-5-3-2-4-11(12)13(16)17/h2-5,10H,6-9H2,1H3,(H,16,17)