2-(5-cyano-8-fluoranyl-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)ethanoic acid

Systemtic Name: 2-(5-cyano-8-fluoranyl-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)ethanoic acid Openeye Name: 2-(5-cyano-8-fluoro-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid CAS Name: 2-(5-cyano-8-fluoro-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid IUPAC Name: 2-(5-cyano-8-fluoro-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid Traditional Name: 2-(5-cyano-8-fluoro-1-propyl-2,3,4,4a,9,9a-hexahydrocarbazol-1-yl)acetic acid Formula: C18H21FN2O2 MolecularWeight: 316.369943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCC2C1NC3=C(C=CC(=C23)C#N)F)CC(=O)O

Isomeric SMILES

CCCC1(CCCC2C1NC3=C(C=CC(=C23)C#N)F)CC(=O)O

InChI

InChI=1S/C18H21FN2O2/c1-2-7-18(9-14(22)23)8-3-4-12-15-11(10-20)5-6-13(19)16(15)21-17(12)18/h5-6,12,17,21H,2-4,7-9H2,1H3,(H,22,23)