3-(5-bromanyl-2-methyl-6-oxidanyl-3,4-dihydrobenzo[h]chromen-2-yl)propanoic acid

Systemtic Name: 3-(5-bromanyl-2-methyl-6-oxidanyl-3,4-dihydrobenzo[h]chromen-2-yl)propanoic acid Openeye Name: 3-(5-bromo-6-hydroxy-2-methyl-3,4-dihydrobenzo[h]chromen-2-yl)propanoic acid CAS Name: 3-(5-bromo-6-hydroxy-2-methyl-3,4-dihydrobenzo[h][1]benzopyran-2-yl)propanoic acid IUPAC Name: 3-(5-bromo-6-hydroxy-2-methyl-3,4-dihydrobenzo[h]chromen-2-yl)propanoic acid Traditional Name: 3-(5-bromo-6-hydroxy-2-methyl-3,4-dihydrobenzo[h]chromen-2-yl)propionic acid Formula: C17H17BrO4 MolecularWeight: 365.21848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C3=CC=CC=C3C(=C2Br)O)CCC(=O)O

Isomeric SMILES

CC1(CCC2=C(O1)C3=CC=CC=C3C(=C2Br)O)CCC(=O)O

InChI

InChI=1S/C17H17BrO4/c1-17(9-7-13(19)20)8-6-12-14(18)15(21)10-4-2-3-5-11(10)16(12)22-17/h2-5,21H,6-9H2,1H3,(H,19,20)