2-[2-(5-bromanyl-2-methoxy-phenyl)-7-methyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)-7-methyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)-7-methyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(5-bromo-2-methoxyphenyl)-7-methyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)-7-methyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)-7-methyl-1H-indol-3-yl]acetic acid Formula: C18H16BrNO3 MolecularWeight: 374.22854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C18H16BrNO3/c1-10-4-3-5-12-13(9-16(21)22)18(20-17(10)12)14-8-11(19)6-7-15(14)23-2/h3-8,20H,9H2,1-2H3,(H,21,22)