pentyl 1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: pentyl 1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: pentyl 1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid pentyl ester IUPAC Name: pentyl 1-(trifluoromethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(trifluoromethyl)-9H-$b-carboline-3-carboxylic acid amyl ester Formula: C18H17F3N2O2 MolecularWeight: 350.33499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C(F)(F)F

Isomeric SMILES

CCCCCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O2/c1-2-3-6-9-25-17(24)14-10-12-11-7-4-5-8-13(11)22-15(12)16(23-14)18(19,20)21/h4-5,7-8,10,22H,2-3,6,9H2,1H3