2-[(4S)-5-bromanyl-7-methyl-6-oxidanyl-2-(2-oxidanylpropan-2-yl)-3,4-dihydro-2H-chromen-4-yl]ethyl ethanoate

Systemtic Name: 2-[(4S)-5-bromanyl-7-methyl-6-oxidanyl-2-(2-oxidanylpropan-2-yl)-3,4-dihydro-2H-chromen-4-yl]ethyl ethanoate Openeye Name: 2-[(4S)-5-bromo-6-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-7-methyl-chroman-4-yl]ethyl acetate CAS Name: acetic acid 2-[(4S)-5-bromo-6-hydroxy-2-(2-hydroxypropan-2-yl)-7-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]ethyl ester IUPAC Name: 2-[(4S)-5-bromo-6-hydroxy-2-(2-hydroxypropan-2-yl)-7-methyl-3,4-dihydro-2H-chromen-4-yl]ethyl acetate Traditional Name: acetic acid 2-[(4S)-5-bromo-6-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-7-methyl-chroman-4-yl]ethyl ester Formula: C17H23BrO5 MolecularWeight: 387.26552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(CC(O2)C(C)(C)O)CCOC(=O)C)C(=C1O)Br

Isomeric SMILES

CC1=CC2=C([C@H](CC(O2)C(C)(C)O)CCOC(=O)C)C(=C1O)Br

InChI

InChI=1S/C17H23BrO5/c1-9-7-12-14(15(18)16(9)20)11(5-6-22-10(2)19)8-13(23-12)17(3,4)21/h7,11,13,20-21H,5-6,8H2,1-4H3/t11-,13?/m0/s1