2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylethyl 3-chloranylbenzoate

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylethyl 3-chloranylbenzoate Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid 2-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]ethyl ester IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid 2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl ester Formula: C14H12ClNO5S MolecularWeight: 341.76678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)S(=O)(=O)CCOC(=O)C2=CC(=CC=C2)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)S(=O)(=O)CCOC(=O)C2=CC(=CC=C2)Cl)[O-]

InChI

InChI=1S/C14H12ClNO5S/c15-12-5-3-4-11(10-12)14(17)21-8-9-22(19,20)13-6-1-2-7-16(13)18/h1-7,10H,8-9H2