ethyl 2-ethoxycarbonyloxy-3-(2-phenylethynyl)indole-1-carboxylate

Systemtic Name: ethyl 2-ethoxycarbonyloxy-3-(2-phenylethynyl)indole-1-carboxylate Openeye Name: ethyl 2-ethoxycarbonyloxy-3-(2-phenylethynyl)indole-1-carboxylate CAS Name: 2-ethoxycarbonyloxy-3-(2-phenylethynyl)-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-ethoxycarbonyloxy-3-(2-phenylethynyl)indole-1-carboxylate Traditional Name: 2-carbethoxyoxy-3-(2-phenylethynyl)indole-1-carboxylic acid ethyl ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2C(=C1OC(=O)OCC)C#CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2C(=C1OC(=O)OCC)C#CC3=CC=CC=C3

InChI

InChI=1S/C22H19NO5/c1-3-26-21(24)23-19-13-9-8-12-17(19)18(20(23)28-22(25)27-4-2)15-14-16-10-6-5-7-11-16/h5-13H,3-4H2,1-2H3