ethyl 2-ethynyl-4-(2,2,4,4-tetramethyl-3H-thiochromen-7-yl)benzoate

Systemtic Name: ethyl 2-ethynyl-4-(2,2,4,4-tetramethyl-3H-thiochromen-7-yl)benzoate Openeye Name: ethyl 2-ethynyl-4-(2,2,4,4-tetramethylthiochroman-7-yl)benzoate CAS Name: 2-ethynyl-4-(2,2,4,4-tetramethyl-3H-1-benzothiopyran-7-yl)benzoic acid ethyl ester IUPAC Name: ethyl 2-ethynyl-4-(2,2,4,4-tetramethyl-3H-thiochromen-7-yl)benzoate Traditional Name: 2-ethynyl-4-(2,2,4,4-tetramethylthiochroman-7-yl)benzoic acid ethyl ester Formula: C24H26O2S MolecularWeight: 378.52704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)C(CC(S3)(C)C)(C)C)C#C

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)C2=CC3=C(C=C2)C(CC(S3)(C)C)(C)C)C#C

InChI

InChI=1S/C24H26O2S/c1-7-16-13-17(9-11-19(16)22(25)26-8-2)18-10-12-20-21(14-18)27-24(5,6)15-23(20,3)4/h1,9-14H,8,15H2,2-6H3