ethyl 2-methyl-4-[(E)-2-(2,2,4,4-tetramethyl-3H-thiochromen-6-yl)prop-1-enyl]benzoate

Systemtic Name: ethyl 2-methyl-4-[(E)-2-(2,2,4,4-tetramethyl-3H-thiochromen-6-yl)prop-1-enyl]benzoate Openeye Name: ethyl 2-methyl-4-[(E)-2-(2,2,4,4-tetramethylthiochroman-6-yl)prop-1-enyl]benzoate CAS Name: 2-methyl-4-[(E)-2-(2,2,4,4-tetramethyl-3H-1-benzothiopyran-6-yl)prop-1-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[(E)-2-(2,2,4,4-tetramethyl-3H-thiochromen-6-yl)prop-1-enyl]benzoate Traditional Name: 2-methyl-4-[(E)-2-(2,2,4,4-tetramethylthiochroman-6-yl)prop-1-enyl]benzoic acid ethyl ester Formula: C26H32O2S MolecularWeight: 408.59608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)C=C(C)C2=CC3=C(C=C2)SC(CC3(C)C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)/C=C(\C)/C2=CC3=C(C=C2)SC(CC3(C)C)(C)C)C

InChI

InChI=1S/C26H32O2S/c1-8-28-24(27)21-11-9-19(14-18(21)3)13-17(2)20-10-12-23-22(15-20)25(4,5)16-26(6,7)29-23/h9-15H,8,16H2,1-7H3/b17-13+