4-[(5-chloranyl-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium Openeye Name: 4-[(5-chloro-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium CAS Name: 4-[(5-chloro-2-methoxyphenyl)sulfonylmethyl]piperidin-1-ium IUPAC Name: 4-[(5-chloro-2-methoxyphenyl)sulfonylmethyl]piperidin-1-ium Traditional Name: 4-[(5-chloro-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium Formula: C13H19ClNO3S+ MolecularWeight: 304.81286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)CC2CC[NH2+]CC2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)CC2CC[NH2+]CC2

InChI

InChI=1S/C13H18ClNO3S/c1-18-12-3-2-11(14)8-13(12)19(16,17)9-10-4-6-15-7-5-10/h2-3,8,10,15H,4-7,9H2,1H3/p+1