(E)-3-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-2-(benzenesulfonyl)-3-(4-hydroxy-3,5-diisopropyl-phenyl)prop-2-enenitrile CAS Name: (E)-2-(benzenesulfonyl)-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(benzenesulfonyl)-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-besyl-3-(4-hydroxy-3,5-diisopropyl-phenyl)acrylonitrile Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO3S/c1-14(2)19-11-16(12-20(15(3)4)21(19)23)10-18(13-22)26(24,25)17-8-6-5-7-9-17/h5-12,14-15,23H,1-4H3/b18-10+