tert-butyl 6-cyano-2-(4-cyanophenyl)indole-1-carboxylate

Systemtic Name: tert-butyl 6-cyano-2-(4-cyanophenyl)indole-1-carboxylate Openeye Name: tert-butyl 6-cyano-2-(4-cyanophenyl)indole-1-carboxylate CAS Name: 6-cyano-2-(4-cyanophenyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-cyano-2-(4-cyanophenyl)indole-1-carboxylate Traditional Name: 6-cyano-2-(4-cyanophenyl)indole-1-carboxylic acid tert-butyl ester Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=CC2=C1C=C(C=C2)C#N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=CC2=C1C=C(C=C2)C#N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17N3O2/c1-21(2,3)26-20(25)24-18-10-15(13-23)6-9-17(18)11-19(24)16-7-4-14(12-22)5-8-16/h4-11H,1-3H3