ethyl 1-methyl-3-octanoyl-indole-2-carboxylate

Systemtic Name: ethyl 1-methyl-3-octanoyl-indole-2-carboxylate Openeye Name: ethyl 1-methyl-3-octanoyl-indole-2-carboxylate CAS Name: 1-methyl-3-(1-oxooctyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-3-octanoylindole-2-carboxylate Traditional Name: 3-caprylyl-1-methyl-indole-2-carboxylic acid ethyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)C)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)C)C(=O)OCC

InChI

InChI=1S/C20H27NO3/c1-4-6-7-8-9-14-17(22)18-15-12-10-11-13-16(15)21(3)19(18)20(23)24-5-2/h10-13H,4-9,14H2,1-3H3