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

Systemtic Name: [4-methoxy-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]methylazanium Openeye Name: [4-methoxy-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]methylammonium CAS Name: [4-methoxy-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]methylammonium IUPAC Name: [4-methoxy-3-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]methylazanium Traditional Name: [4-methoxy-3-[(3S)-3-methylpiperidino]sulfonyl-benzyl]ammonium Formula: C14H23N2O3S+ MolecularWeight: 299.40902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S/c1-11-4-3-7-16(10-11)20(17,18)14-8-12(9-15)5-6-13(14)19-2/h5-6,8,11H,3-4,7,9-10,15H2,1-2H3/p+1/t11-/m0/s1