2-(4-butoxyphenyl)sulfonyl-8-fluoranyl-1,3,4,5-tetrahydropyrido[4,3-b]indole

Systemtic Name: 2-(4-butoxyphenyl)sulfonyl-8-fluoranyl-1,3,4,5-tetrahydropyrido[4,3-b]indole Openeye Name: 2-(4-butoxyphenyl)sulfonyl-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole CAS Name: 2-(4-butoxyphenyl)sulfonyl-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole IUPAC Name: 2-(4-butoxyphenyl)sulfonyl-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole Traditional Name: 2-(4-butoxyphenyl)sulfonyl-8-fluoro-1,3,4,5-tetrahydropyrid[4,3-b]indole Formula: C21H23FN2O3S MolecularWeight: 402.482323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)F

InChI

InChI=1S/C21H23FN2O3S/c1-2-3-12-27-16-5-7-17(8-6-16)28(25,26)24-11-10-21-19(14-24)18-13-15(22)4-9-20(18)23-21/h4-9,13,23H,2-3,10-12,14H2,1H3