2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzenecarbonitrile Openeye Name: 2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzonitrile CAS Name: 2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzonitrile IUPAC Name: 2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzonitrile Traditional Name: 2-[[4-(2,4,6-trimethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]benzonitrile Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C2=CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)C2=CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)OC

InChI

InChI=1S/C21H22N2O5S/c1-26-17-12-18(27-2)21(19(13-17)28-3)15-8-10-23(11-9-15)29(24,25)20-7-5-4-6-16(20)14-22/h4-8,12-13H,9-11H2,1-3H3