anthracen-1-yl 6-ethyl-4,4-dimethyl-1-(5-methylthiophen-2-yl)cyclohex-2-ene-1-carboxylate

Systemtic Name: anthracen-1-yl 6-ethyl-4,4-dimethyl-1-(5-methylthiophen-2-yl)cyclohex-2-ene-1-carboxylate Openeye Name: 1-anthryl 6-ethyl-4,4-dimethyl-1-(5-methyl-2-thienyl)cyclohex-2-ene-1-carboxylate CAS Name: 6-ethyl-4,4-dimethyl-1-(5-methyl-2-thiophenyl)-1-cyclohex-2-enecarboxylic acid 1-anthracenyl ester IUPAC Name: anthracen-1-yl 6-ethyl-4,4-dimethyl-1-(5-methylthiophen-2-yl)cyclohex-2-ene-1-carboxylate Traditional Name: 6-ethyl-4,4-dimethyl-1-(5-methyl-2-thienyl)cyclohex-2-ene-1-carboxylic acid 1-anthryl ester Formula: C30H30O2S MolecularWeight: 454.623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C=CC1(C2=CC=C(S2)C)C(=O)OC3=CC=CC4=CC5=CC=CC=C5C=C43)(C)C

Isomeric SMILES

CCC1CC(C=CC1(C2=CC=C(S2)C)C(=O)OC3=CC=CC4=CC5=CC=CC=C5C=C43)(C)C

InChI

InChI=1S/C30H30O2S/c1-5-24-19-29(3,4)15-16-30(24,27-14-13-20(2)33-27)28(31)32-26-12-8-11-23-17-21-9-6-7-10-22(21)18-25(23)26/h6-18,24H,5,19H2,1-4H3