(2S,4S)-4-tert-butyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]cyclohexan-1-one

Systemtic Name: (2S,4S)-4-tert-butyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]cyclohexan-1-one Openeye Name: (2S,4S)-4-tert-butyl-2-[(E)-3-(2-thienyl)prop-2-enoyl]cyclohexanone CAS Name: (2S,4S)-4-tert-butyl-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-cyclohexanone IUPAC Name: (2S,4S)-4-tert-butyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]cyclohexan-1-one Traditional Name: (2S,4S)-4-tert-butyl-2-[(E)-3-(2-thienyl)acryloyl]cyclohexanone Formula: C17H22O2S MolecularWeight: 290.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=O)C(C1)C(=O)C=CC2=CC=CS2

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=O)[C@H](C1)C(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C17H22O2S/c1-17(2,3)12-6-8-15(18)14(11-12)16(19)9-7-13-5-4-10-20-13/h4-5,7,9-10,12,14H,6,8,11H2,1-3H3/b9-7+/t12-,14-/m0/s1