2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-6-chloranyl-7-methyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(2-bromanyl-4,5-dimethoxy-phenyl)-6-chloranyl-7-methyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(2-bromo-4,5-dimethoxy-phenyl)-6-chloro-7-methyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(2-bromo-4,5-dimethoxyphenyl)-6-chloro-7-methyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(2-bromo-4,5-dimethoxyphenyl)-6-chloro-7-methyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(2-bromo-4,5-dimethoxy-phenyl)-6-chloro-7-methyl-1H-indol-3-yl]acetic acid Formula: C19H17BrClNO4 MolecularWeight: 438.69958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1NC(=C2CC(=O)O)C3=CC(=C(C=C3Br)OC)OC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1NC(=C2CC(=O)O)C3=CC(=C(C=C3Br)OC)OC)Cl

InChI

InChI=1S/C19H17BrClNO4/c1-9-14(21)5-4-10-11(7-17(23)24)19(22-18(9)10)12-6-15(25-2)16(26-3)8-13(12)20/h4-6,8,22H,7H2,1-3H3,(H,23,24)