pyridin-1-ium-2-ylmethyl 5-[(2-chloranylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: pyridin-1-ium-2-ylmethyl 5-[(2-chloranylphenoxy)methyl]furan-2-carboxylate Openeye Name: pyridin-1-ium-2-ylmethyl 5-[(2-chlorophenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(2-chlorophenoxy)methyl]-2-furancarboxylic acid 2-pyridin-1-iumylmethyl ester IUPAC Name: pyridin-1-ium-2-ylmethyl 5-[(2-chlorophenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(2-chlorophenoxy)methyl]furan-2-carboxylic acid pyridin-1-ium-2-ylmethyl ester Formula: C18H15ClNO4+ MolecularWeight: 344.769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC2=CC=C(O2)C(=O)OCC3=CC=CC=[NH+]3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCC2=CC=C(O2)C(=O)OCC3=CC=CC=[NH+]3)Cl

InChI

InChI=1S/C18H14ClNO4/c19-15-6-1-2-7-16(15)22-12-14-8-9-17(24-14)18(21)23-11-13-5-3-4-10-20-13/h1-10H,11-12H2/p+1