(3S)-6-bromanyl-8-methoxy-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: (3S)-6-bromanyl-8-methoxy-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: (3S)-6-bromo-8-methoxy-chromane-3-carboxylic acid CAS Name: (3S)-6-bromo-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: (3S)-6-bromo-8-methoxy-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: (3S)-6-bromo-8-methoxy-chroman-3-carboxylic acid Formula: C11H11BrO4 MolecularWeight: 287.10664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)CC(CO2)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)C[C@@H](CO2)C(=O)O

InChI

InChI=1S/C11H11BrO4/c1-15-9-4-8(12)3-6-2-7(11(13)14)5-16-10(6)9/h3-4,7H,2,5H2,1H3,(H,13,14)/t7-/m0/s1