3-(4-chloranylbutanoyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile

Systemtic Name: 3-(4-chloranylbutanoyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile Openeye Name: 3-(4-chlorobutanoyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile CAS Name: 3-(4-chloro-1-oxobutyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile IUPAC Name: 3-(4-chlorobutanoyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile Traditional Name: 3-(4-chlorobutanoyl)-2,3,5,6-tetrahydro-1H-indole-5-carbonitrile Formula: C13H15ClN2O MolecularWeight: 250.724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=C2C(=CC1C#N)C(CN2)C(=O)CCCCl

Isomeric SMILES

C1C=C2C(=CC1C#N)C(CN2)C(=O)CCCCl

InChI

InChI=1S/C13H15ClN2O/c14-5-1-2-13(17)11-8-16-12-4-3-9(7-15)6-10(11)12/h4,6,9,11,16H,1-3,5,8H2