2-piperidin-1-ium-1-ylethyl 3,4-bis(oxidanyl)benzoate

Systemtic Name: 2-piperidin-1-ium-1-ylethyl 3,4-bis(oxidanyl)benzoate Openeye Name: 2-piperidin-1-ium-1-ylethyl 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid 2-(1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-piperidin-1-ium-1-ylethyl 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid 2-piperidin-1-ium-1-ylethyl ester Formula: C14H20NO4+ MolecularWeight: 266.3129

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c16-12-5-4-11(10-13(12)17)14(18)19-9-8-15-6-2-1-3-7-15/h4-5,10,16-17H,1-3,6-9H2/p+1