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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(OC2=CC(=C1O)Br)C(C)(C)O)CCOC(=O)C

Isomeric SMILES

CC1=C2C(CC(OC2=CC(=C1O)Br)C(C)(C)O)CCOC(=O)C

InChI

InChI=1S/C17H23BrO5/c1-9-15-11(5-6-22-10(2)19)7-14(17(3,4)21)23-13(15)8-12(18)16(9)20/h8,11,14,20-21H,5-7H2,1-4H3