methyl 3-dodecanoyl-1H-indole-6-carboxylate

Systemtic Name: methyl 3-dodecanoyl-1H-indole-6-carboxylate Openeye Name: methyl 3-dodecanoyl-1H-indole-6-carboxylate CAS Name: 3-(1-oxododecyl)-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-dodecanoyl-1H-indole-6-carboxylate Traditional Name: 3-lauroyl-1H-indole-6-carboxylic acid methyl ester Formula: C22H31NO3 MolecularWeight: 357.48644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CNC2=C1C=CC(=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CNC2=C1C=CC(=C2)C(=O)OC

InChI

InChI=1S/C22H31NO3/c1-3-4-5-6-7-8-9-10-11-12-21(24)19-16-23-20-15-17(22(25)26-2)13-14-18(19)20/h13-16,23H,3-12H2,1-2H3