ethyl 1-butyl-5,6,7-tris(chloranyl)-2-methyl-4-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 1-butyl-5,6,7-tris(chloranyl)-2-methyl-4-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 1-butyl-5,6,7-trichloro-4-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 1-butyl-5,6,7-trichloro-4-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-5,6,7-trichloro-4-hydroxy-2-methylindole-3-carboxylate Traditional Name: 1-butyl-5,6,7-trichloro-4-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C16H18Cl3NO3 MolecularWeight: 378.67802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C(=C(C(=C2O)Cl)Cl)Cl)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C(=C(C(=C2O)Cl)Cl)Cl)C(=O)OCC)C

InChI

InChI=1S/C16H18Cl3NO3/c1-4-6-7-20-8(3)9(16(22)23-5-2)10-14(20)12(18)11(17)13(19)15(10)21/h21H,4-7H2,1-3H3