1-(2-ethyloctyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole

Systemtic Name: 1-(2-ethyloctyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole Openeye Name: 1-(2-ethyloctyl)-2-(5-ethylsulfonyl-2-methoxy-phenyl)pyrrole CAS Name: 1-(2-ethyloctyl)-2-(5-ethylsulfonyl-2-methoxyphenyl)pyrrole IUPAC Name: 1-(2-ethyloctyl)-2-(5-ethylsulfonyl-2-methoxyphenyl)pyrrole Traditional Name: 2-(5-esyl-2-methoxy-phenyl)-1-(2-ethyloctyl)pyrrole Formula: C23H35NO3S MolecularWeight: 405.5939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)CN1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

Isomeric SMILES

CCCCCCC(CC)CN1C=CC=C1C2=C(C=CC(=C2)S(=O)(=O)CC)OC

InChI

InChI=1S/C23H35NO3S/c1-5-8-9-10-12-19(6-2)18-24-16-11-13-22(24)21-17-20(28(25,26)7-3)14-15-23(21)27-4/h11,13-17,19H,5-10,12,18H2,1-4H3