1-hexyl-2,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 1-hexyl-2,3-dimethyl-indole-5-carboxylic acid Openeye Name: 1-hexyl-2,3-dimethyl-indole-5-carboxylic acid CAS Name: 1-hexyl-2,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 1-hexyl-2,3-dimethylindole-5-carboxylic acid Traditional Name: 1-hexyl-2,3-dimethyl-indole-5-carboxylic acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

Isomeric SMILES

CCCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

InChI

InChI=1S/C17H23NO2/c1-4-5-6-7-10-18-13(3)12(2)15-11-14(17(19)20)8-9-16(15)18/h8-9,11H,4-7,10H2,1-3H3,(H,19,20)