2-[4-methoxy-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]ethylazanium

Systemtic Name: 2-[4-methoxy-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]ethylazanium Openeye Name: 2-[4-methoxy-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]ethylammonium CAS Name: 2-[4-methoxy-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]ethylammonium IUPAC Name: 2-[4-methoxy-3-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]ethylazanium Traditional Name: 2-[4-methoxy-3-[(3S)-3-methylpiperidino]sulfonyl-phenyl]ethylammonium Formula: C15H25N2O3S+ MolecularWeight: 313.4356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)CC[NH3+])OC

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)CC[NH3+])OC

InChI

InChI=1S/C15H24N2O3S/c1-12-4-3-9-17(11-12)21(18,19)15-10-13(7-8-16)5-6-14(15)20-2/h5-6,10,12H,3-4,7-9,11,16H2,1-2H3/p+1/t12-/m0/s1