3-hexadecanoyl-1H-indole-6-carboxylic acid

Systemtic Name: 3-hexadecanoyl-1H-indole-6-carboxylic acid Openeye Name: 3-hexadecanoyl-1H-indole-6-carboxylic acid CAS Name: 3-(1-oxohexadecyl)-1H-indole-6-carboxylic acid IUPAC Name: 3-hexadecanoyl-1H-indole-6-carboxylic acid Traditional Name: 3-hexadecanoyl-1H-indole-6-carboxylic acid Formula: C25H37NO3 MolecularWeight: 399.56618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24(27)22-19-26-23-18-20(25(28)29)16-17-21(22)23/h16-19,26H,2-15H2,1H3,(H,28,29)