3-(8-chloranyl-4-cyano-pyrido[4,3-b]indol-5-yl)propanoic acid

Systemtic Name: 3-(8-chloranyl-4-cyano-pyrido[4,3-b]indol-5-yl)propanoic acid Openeye Name: 3-(8-chloro-4-cyano-pyrido[4,3-b]indol-5-yl)propanoic acid CAS Name: 3-(8-chloro-4-cyano-5-pyrido[4,3-b]indolyl)propanoic acid IUPAC Name: 3-(8-chloro-4-cyanopyrido[4,3-b]indol-5-yl)propanoic acid Traditional Name: 3-(8-chloro-4-cyano-pyrid[4,3-b]indol-5-yl)propionic acid Formula: C15H10ClN3O2 MolecularWeight: 299.7118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C3=C(N2CCC(=O)O)C(=CN=C3)C#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)C3=C(N2CCC(=O)O)C(=CN=C3)C#N

InChI

InChI=1S/C15H10ClN3O2/c16-10-1-2-13-11(5-10)12-8-18-7-9(6-17)15(12)19(13)4-3-14(20)21/h1-2,5,7-8H,3-4H2,(H,20,21)