(6-oxidanyl-1H-indol-5-yl) butanoate

Systemtic Name: (6-oxidanyl-1H-indol-5-yl) butanoate Openeye Name: (6-hydroxy-1H-indol-5-yl) butanoate CAS Name: butanoic acid (6-hydroxy-1H-indol-5-yl) ester IUPAC Name: (6-hydroxy-1H-indol-5-yl) butanoate Traditional Name: butyric acid (6-hydroxy-1H-indol-5-yl) ester Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C2C(=C1)C=CN2)O

Isomeric SMILES

CCCC(=O)OC1=C(C=C2C(=C1)C=CN2)O

InChI

InChI=1S/C12H13NO3/c1-2-3-12(15)16-11-6-8-4-5-13-9(8)7-10(11)14/h4-7,13-14H,2-3H2,1H3