3-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[[4-[2-(4-methoxyphenyl)ethyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 3-[[4-[2-(4-methoxyphenyl)ethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperidino]sulfonylbenzonitrile Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H24N2O3S/c1-26-20-9-7-17(8-10-20)5-6-18-11-13-23(14-12-18)27(24,25)21-4-2-3-19(15-21)16-22/h2-4,7-10,15,18H,5-6,11-14H2,1H3