2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenoxy]ethanal

Systemtic Name: 2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenoxy]ethanal Openeye Name: 2-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenoxy]acetaldehyde CAS Name: 2-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenoxy]acetaldehyde IUPAC Name: 2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenoxy]acetaldehyde Traditional Name: 2-[4-[(3S)-3-methylpiperidino]sulfonylphenoxy]acetaldehyde Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OCC=O

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OCC=O

InChI

InChI=1S/C14H19NO4S/c1-12-3-2-8-15(11-12)20(17,18)14-6-4-13(5-7-14)19-10-9-16/h4-7,9,12H,2-3,8,10-11H2,1H3/t12-/m0/s1