tert-butyl 2-ethyl-3-heptyl-indole-1-carboxylate

Systemtic Name: tert-butyl 2-ethyl-3-heptyl-indole-1-carboxylate Openeye Name: tert-butyl 2-ethyl-3-heptyl-indole-1-carboxylate CAS Name: 2-ethyl-3-heptyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-ethyl-3-heptylindole-1-carboxylate Traditional Name: 2-ethyl-3-heptyl-indole-1-carboxylic acid tert-butyl ester Formula: C22H33NO2 MolecularWeight: 343.50292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)CC

Isomeric SMILES

CCCCCCCC1=C(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)CC

InChI

InChI=1S/C22H33NO2/c1-6-8-9-10-11-14-17-18-15-12-13-16-20(18)23(19(17)7-2)21(24)25-22(3,4)5/h12-13,15-16H,6-11,14H2,1-5H3