2-chloranyl-6-[4-[2-(hydroxymethyl)piperidin-1-yl]sulfonylphenoxy]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[4-[2-(hydroxymethyl)piperidin-1-yl]sulfonylphenoxy]benzenecarbonitrile Openeye Name: 2-chloro-6-[4-[[2-(hydroxymethyl)-1-piperidyl]sulfonyl]phenoxy]benzonitrile CAS Name: 2-chloro-6-[4-[[2-(hydroxymethyl)-1-piperidinyl]sulfonyl]phenoxy]benzonitrile IUPAC Name: 2-chloro-6-[4-[2-(hydroxymethyl)piperidin-1-yl]sulfonylphenoxy]benzonitrile Traditional Name: 2-chloro-6-[4-(2-methylolpiperidino)sulfonylphenoxy]benzonitrile Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

Isomeric SMILES

C1CCN(C(C1)CO)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

InChI

InChI=1S/C19H19ClN2O4S/c20-18-5-3-6-19(17(18)12-21)26-15-7-9-16(10-8-15)27(24,25)22-11-2-1-4-14(22)13-23/h3,5-10,14,23H,1-2,4,11,13H2