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

Systemtic Name: 3-dodecyl-1H-indole-6-carboxylic acid Openeye Name: 3-dodecyl-1H-indole-6-carboxylic acid CAS Name: 3-dodecyl-1H-indole-6-carboxylic acid IUPAC Name: 3-dodecyl-1H-indole-6-carboxylic acid Traditional Name: 3-lauryl-1H-indole-6-carboxylic acid Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CNC2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CNC2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C21H31NO2/c1-2-3-4-5-6-7-8-9-10-11-12-18-16-22-20-15-17(21(23)24)13-14-19(18)20/h13-16,22H,2-12H2,1H3,(H,23,24)