(3S)-3-[(5-chloranyl-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(5-chloranyl-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium Openeye Name: (3S)-3-[(5-chloro-2-methoxy-phenyl)sulfonylmethyl]piperidin-1-ium CAS Name: (3S)-3-[(5-chloro-2-methoxyphenyl)sulfonylmethyl]piperidin-1-ium IUPAC Name: (3S)-3-[(5-chloro-2-methoxyphenyl)sulfonylmethyl]piperidin-1-ium Traditional Name: (3S)-3-[(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)CC2CCC[NH2+]C2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)C[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H18ClNO3S/c1-18-12-5-4-11(14)7-13(12)19(16,17)9-10-3-2-6-15-8-10/h4-5,7,10,15H,2-3,6,8-9H2,1H3/p+1/t10-/m0/s1