naphthalen-1-ylmethyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: 1-naphthylmethyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid 1-naphthylmethyl ester Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C17H13NO3/c19-17(14-8-10-18(20)11-9-14)21-12-15-6-3-5-13-4-1-2-7-16(13)15/h1-11H,12H2