ethyl 5-(2-ethoxy-2-oxidanylidene-ethoxy)-1-(4-iodophenyl)-2-methyl-indole-3-carboxylate

Systemtic Name: ethyl 5-(2-ethoxy-2-oxidanylidene-ethoxy)-1-(4-iodophenyl)-2-methyl-indole-3-carboxylate Openeye Name: ethyl 5-(2-ethoxy-2-oxo-ethoxy)-1-(4-iodophenyl)-2-methyl-indole-3-carboxylate CAS Name: 5-(2-ethoxy-2-oxoethoxy)-1-(4-iodophenyl)-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-ethoxy-2-oxoethoxy)-1-(4-iodophenyl)-2-methylindole-3-carboxylate Traditional Name: 5-(2-ethoxy-2-keto-ethoxy)-1-(4-iodophenyl)-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C22H22INO5 MolecularWeight: 507.31825

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C3=CC=C(C=C3)I

Isomeric SMILES

CCOC(=O)COC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C3=CC=C(C=C3)I

InChI

InChI=1S/C22H22INO5/c1-4-27-20(25)13-29-17-10-11-19-18(12-17)21(22(26)28-5-2)14(3)24(19)16-8-6-15(23)7-9-16/h6-12H,4-5,13H2,1-3H3