2,2,2-tris(chloranyl)ethyl 3-carbonazidoylindole-1-carboxylate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-carbonazidoylindole-1-carboxylate Openeye Name: 2,2,2-trichloroethyl 3-carbonazidoylindole-1-carboxylate CAS Name: 3-carbonazidoyl-1-indolecarboxylic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-carbonazidoylindole-1-carboxylate Traditional Name: 3-carbonazidoylindole-1-carboxylic acid 2,2,2-trichloroethyl ester Formula: C12H7Cl3N4O3 MolecularWeight: 361.56798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)OCC(Cl)(Cl)Cl)C(=O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)OCC(Cl)(Cl)Cl)C(=O)N=[N+]=[N-]

InChI

InChI=1S/C12H7Cl3N4O3/c13-12(14,15)6-22-11(21)19-5-8(10(20)17-18-16)7-3-1-2-4-9(7)19/h1-5H,6H2