2-[5,6,7-tris(chloranyl)-3-ethanoyl-2-methyl-1-(phenylmethyl)indol-4-yl]oxyethanoate

Systemtic Name: 2-[5,6,7-tris(chloranyl)-3-ethanoyl-2-methyl-1-(phenylmethyl)indol-4-yl]oxyethanoate Openeye Name: 2-(3-acetyl-1-benzyl-5,6,7-trichloro-2-methyl-indol-4-yl)oxyacetate CAS Name: 2-[[3-acetyl-5,6,7-trichloro-2-methyl-1-(phenylmethyl)-4-indolyl]oxy]acetate IUPAC Name: 2-(3-acetyl-1-benzyl-5,6,7-trichloro-2-methylindol-4-yl)oxyacetate Traditional Name: 2-(3-acetyl-1-benzyl-5,6,7-trichloro-2-methyl-indol-4-yl)oxyacetate Formula: C20H15Cl3NO4- MolecularWeight: 439.6964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=C(C(=C2OCC(=O)[O-])Cl)Cl)Cl)C(=O)C

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C(=C(C(=C2OCC(=O)[O-])Cl)Cl)Cl)C(=O)C

InChI

InChI=1S/C20H16Cl3NO4/c1-10-14(11(2)25)15-19(24(10)8-12-6-4-3-5-7-12)17(22)16(21)18(23)20(15)28-9-13(26)27/h3-7H,8-9H2,1-2H3,(H,26,27)/p-1