3-[4-(3-pyridin-3-ylphenoxy)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-(3-pyridin-3-ylphenoxy)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[[4-[3-(3-pyridyl)phenoxy]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 3-[[4-[3-(3-pyridinyl)phenoxy]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(3-pyridin-3-ylphenoxy)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-[3-(3-pyridyl)phenoxy]piperidino]sulfonylbenzonitrile Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC(=C2)C3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1OC2=CC=CC(=C2)C3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H21N3O3S/c24-16-18-4-1-8-23(14-18)30(27,28)26-12-9-21(10-13-26)29-22-7-2-5-19(15-22)20-6-3-11-25-17-20/h1-8,11,14-15,17,21H,9-10,12-13H2