3-(5-cyano-1H-indol-3-yl)propanoic acid

Systemtic Name: 3-(5-cyano-1H-indol-3-yl)propanoic acid Openeye Name: 3-(5-cyano-1H-indol-3-yl)propanoic acid CAS Name: 3-(5-cyano-1H-indol-3-yl)propanoic acid IUPAC Name: 3-(5-cyano-1H-indol-3-yl)propanoic acid Traditional Name: 3-(5-cyano-1H-indol-3-yl)propionic acid Formula: C12H10N2O2 MolecularWeight: 214.22

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C(=CN2)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C#N)C(=CN2)CCC(=O)O

InChI

InChI=1S/C12H10N2O2/c13-6-8-1-3-11-10(5-8)9(7-14-11)2-4-12(15)16/h1,3,5,7,14H,2,4H2,(H,15,16)