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

Systemtic Name: methyl 3-hexadecyl-1H-indole-5-carboxylate Openeye Name: methyl 3-hexadecyl-1H-indole-5-carboxylate CAS Name: 3-hexadecyl-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-hexadecyl-1H-indole-5-carboxylate Traditional Name: 3-cetyl-1H-indole-5-carboxylic acid methyl ester Formula: C26H41NO2 MolecularWeight: 399.60924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CNC2=C1C=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CNC2=C1C=C(C=C2)C(=O)OC

InChI

InChI=1S/C26H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-21-27-25-19-18-22(20-24(23)25)26(28)29-2/h18-21,27H,3-17H2,1-2H3