5-[(E)-2-(3-hexyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]thiophene-2-carboxylate

Systemtic Name: 5-[(E)-2-(3-hexyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]thiophene-2-carboxylate Openeye Name: 5-[(E)-2-(7-hexyl-1,1,4,4-tetramethyl-tetralin-6-yl)vinyl]thiophene-2-carboxylate CAS Name: 5-[(E)-2-(3-hexyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]-2-thiophenecarboxylate IUPAC Name: 5-[(E)-2-(3-hexyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]thiophene-2-carboxylate Traditional Name: 5-[(E)-2-(7-hexyl-1,1,4,4-tetramethyl-tetralin-6-yl)vinyl]-2-thenoate Formula: C27H35O2S- MolecularWeight: 423.6306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1C=CC3=CC=C(S3)C(=O)[O-])C(CCC2(C)C)(C)C

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1/C=C/C3=CC=C(S3)C(=O)[O-])C(CCC2(C)C)(C)C

InChI

InChI=1S/C27H36O2S/c1-6-7-8-9-10-19-17-22-23(27(4,5)16-15-26(22,2)3)18-20(19)11-12-21-13-14-24(30-21)25(28)29/h11-14,17-18H,6-10,15-16H2,1-5H3,(H,28,29)/p-1/b12-11+