2-dodecan-3-yl-1H-indole-6-carboxylic acid

Systemtic Name: 2-dodecan-3-yl-1H-indole-6-carboxylic acid Openeye Name: 2-(1-ethyldecyl)-1H-indole-6-carboxylic acid CAS Name: 2-dodecan-3-yl-1H-indole-6-carboxylic acid IUPAC Name: 2-dodecan-3-yl-1H-indole-6-carboxylic acid Traditional Name: 2-(1-ethyldecyl)-1H-indole-6-carboxylic acid Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CC)C1=CC2=C(N1)C=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCC(CC)C1=CC2=C(N1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C21H31NO2/c1-3-5-6-7-8-9-10-11-16(4-2)19-14-17-12-13-18(21(23)24)15-20(17)22-19/h12-16,22H,3-11H2,1-2H3,(H,23,24)