1-[(E)-but-2-enyl]-2,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 1-[(E)-but-2-enyl]-2,3-dimethyl-indole-5-carboxylic acid Openeye Name: 1-[(E)-but-2-enyl]-2,3-dimethyl-indole-5-carboxylic acid CAS Name: 1-[(E)-but-2-enyl]-2,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 1-[(E)-but-2-enyl]-2,3-dimethylindole-5-carboxylic acid Traditional Name: 1-[(E)-but-2-enyl]-2,3-dimethyl-indole-5-carboxylic acid Formula: C15H17NO2 MolecularWeight: 243.30098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

Isomeric SMILES

C/C=C/CN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

InChI

InChI=1S/C15H17NO2/c1-4-5-8-16-11(3)10(2)13-9-12(15(17)18)6-7-14(13)16/h4-7,9H,8H2,1-3H3,(H,17,18)/b5-4+