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

Systemtic Name: methyl 3-octadecanoyl-1H-indole-6-carboxylate Openeye Name: methyl 3-octadecanoyl-1H-indole-6-carboxylate CAS Name: 3-(1-oxooctadecyl)-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-octadecanoyl-1H-indole-6-carboxylate Traditional Name: 3-stearoyl-1H-indole-6-carboxylic acid methyl ester Formula: C28H43NO3 MolecularWeight: 441.64592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27(30)25-22-29-26-21-23(28(31)32-2)19-20-24(25)26/h19-22,29H,3-18H2,1-2H3