ethyl 1-[2-(2,6-dimethylphenoxy)ethyl]-2-methyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 1-[2-(2,6-dimethylphenoxy)ethyl]-2-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 1-[2-(2,6-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 1-[2-(2,6-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,6-dimethylphenoxy)ethyl]-5-hydroxy-2-methylindole-3-carboxylate Traditional Name: 1-[2-(2,6-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCOC3=C(C=CC=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCOC3=C(C=CC=C3C)C)C

InChI

InChI=1S/C22H25NO4/c1-5-26-22(25)20-16(4)23(19-10-9-17(24)13-18(19)20)11-12-27-21-14(2)7-6-8-15(21)3/h6-10,13,24H,5,11-12H2,1-4H3