1-(2,2-dimethylpropyl)indole-3-carboxylic acid

Systemtic Name: 1-(2,2-dimethylpropyl)indole-3-carboxylic acid Openeye Name: 1-(2,2-dimethylpropyl)indole-3-carboxylic acid CAS Name: 1-(2,2-dimethylpropyl)-3-indolecarboxylic acid IUPAC Name: 1-(2,2-dimethylpropyl)indole-3-carboxylic acid Traditional Name: 1-neopentylindole-3-carboxylic acid Formula: C14H17NO2 MolecularWeight: 231.29028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C=C(C2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)(C)CN1C=C(C2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17NO2/c1-14(2,3)9-15-8-11(13(16)17)10-6-4-5-7-12(10)15/h4-8H,9H2,1-3H3,(H,16,17)