methyl 3-hexadecanoyl-1H-indole-5-carboxylate

Systemtic Name: methyl 3-hexadecanoyl-1H-indole-5-carboxylate Openeye Name: methyl 3-hexadecanoyl-1H-indole-5-carboxylate CAS Name: 3-(1-oxohexadecyl)-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-hexadecanoyl-1H-indole-5-carboxylate Traditional Name: 3-hexadecanoyl-1H-indole-5-carboxylic acid methyl ester Formula: C26H39NO3 MolecularWeight: 413.59276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=CNC2=C1C=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=CNC2=C1C=C(C=C2)C(=O)OC

InChI

InChI=1S/C26H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(28)23-20-27-24-18-17-21(19-22(23)24)26(29)30-2/h17-20,27H,3-16H2,1-2H3