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

Systemtic Name: ethyl 1-methyl-3-octadecyl-indole-2-carboxylate Openeye Name: ethyl 1-methyl-3-octadecyl-indole-2-carboxylate CAS Name: 1-methyl-3-octadecyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-3-octadecylindole-2-carboxylate Traditional Name: 1-methyl-3-stearyl-indole-2-carboxylic acid ethyl ester Formula: C30H49NO2 MolecularWeight: 455.71556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(N(C2=CC=CC=C21)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(N(C2=CC=CC=C21)C)C(=O)OCC

InChI

InChI=1S/C30H49NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-26-23-21-22-25-28(26)31(3)29(27)30(32)33-5-2/h21-23,25H,4-20,24H2,1-3H3