pyridin-1-ium-2-ylmethyl 5-(naphthalen-2-yloxymethyl)furan-2-carboxylate

Systemtic Name: pyridin-1-ium-2-ylmethyl 5-(naphthalen-2-yloxymethyl)furan-2-carboxylate Openeye Name: pyridin-1-ium-2-ylmethyl 5-(2-naphthyloxymethyl)furan-2-carboxylate CAS Name: 5-(2-naphthalenyloxymethyl)-2-furancarboxylic acid 2-pyridin-1-iumylmethyl ester IUPAC Name: pyridin-1-ium-2-ylmethyl 5-(naphthalen-2-yloxymethyl)furan-2-carboxylate Traditional Name: 5-(2-naphthoxymethyl)furan-2-carboxylic acid pyridin-1-ium-2-ylmethyl ester Formula: C22H18NO4+ MolecularWeight: 360.38262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OCC3=CC=C(O3)C(=O)OCC4=CC=CC=[NH+]4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OCC3=CC=C(O3)C(=O)OCC4=CC=CC=[NH+]4

InChI

InChI=1S/C22H17NO4/c24-22(26-14-18-7-3-4-12-23-18)21-11-10-20(27-21)15-25-19-9-8-16-5-1-2-6-17(16)13-19/h1-13H,14-15H2/p+1