2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-5,7-dimethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-5,7-dimethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(2-bromo-4,5-dimethoxy-phenyl)-5,7-dimethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(2-bromo-4,5-dimethoxyphenyl)-5,7-dimethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(2-bromo-4,5-dimethoxyphenyl)-5,7-dimethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(2-bromo-4,5-dimethoxy-phenyl)-5,7-dimethyl-1H-indol-3-yl]acetic acid Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC(=C(C=C3Br)OC)OC)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC(=C(C=C3Br)OC)OC)CC(=O)O)C

InChI

InChI=1S/C20H20BrNO4/c1-10-5-11(2)19-12(6-10)13(8-18(23)24)20(22-19)14-7-16(25-3)17(26-4)9-15(14)21/h5-7,9,22H,8H2,1-4H3,(H,23,24)