ethyl 1-butyl-3-iodanyl-2-phenyl-indole-5-carboxylate

Systemtic Name: ethyl 1-butyl-3-iodanyl-2-phenyl-indole-5-carboxylate Openeye Name: ethyl 1-butyl-3-iodo-2-phenyl-indole-5-carboxylate CAS Name: 1-butyl-3-iodo-2-phenyl-5-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-3-iodo-2-phenylindole-5-carboxylate Traditional Name: 1-butyl-3-iodo-2-phenyl-indole-5-carboxylic acid ethyl ester Formula: C21H22INO2 MolecularWeight: 447.30935

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C(=O)OCC)C(=C1C3=CC=CC=C3)I

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C(=O)OCC)C(=C1C3=CC=CC=C3)I

InChI

InChI=1S/C21H22INO2/c1-3-5-13-23-18-12-11-16(21(24)25-4-2)14-17(18)19(22)20(23)15-9-7-6-8-10-15/h6-12,14H,3-5,13H2,1-2H3