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

Systemtic Name: (E)-2-hexylsulfonyl-3-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-hexylsulfonyl-3-(4-hydroxy-3,5-diisopropyl-phenyl)prop-2-enenitrile CAS Name: (E)-2-hexylsulfonyl-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-hexylsulfonyl-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-hexylsulfonyl-3-(4-hydroxy-3,5-diisopropyl-phenyl)acrylonitrile Formula: C21H31NO3S MolecularWeight: 377.54074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C(=CC1=CC(=C(C(=C1)C(C)C)O)C(C)C)C#N

Isomeric SMILES

CCCCCCS(=O)(=O)/C(=C/C1=CC(=C(C(=C1)C(C)C)O)C(C)C)/C#N

InChI

InChI=1S/C21H31NO3S/c1-6-7-8-9-10-26(24,25)18(14-22)11-17-12-19(15(2)3)21(23)20(13-17)16(4)5/h11-13,15-16,23H,6-10H2,1-5H3/b18-11+