(E)-2-(5-chloranylpyridin-2-yl)sulfonyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(5-chloranylpyridin-2-yl)sulfonyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-[(5-chloro-2-pyridyl)sulfonyl]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(5-chloro-2-pyridinyl)sulfonyl]-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(5-chloropyridin-2-yl)sulfonyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-[(5-chloro-2-pyridyl)sulfonyl]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acrylonitrile Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)S(=O)(=O)C2=NC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C#N)/S(=O)(=O)C2=NC=C(C=C2)Cl

InChI

InChI=1S/C22H25ClN2O3S/c1-21(2,3)17-10-14(11-18(20(17)26)22(4,5)6)9-16(12-24)29(27,28)19-8-7-15(23)13-25-19/h7-11,13,26H,1-6H3/b16-9+