3-(2-ethoxyethyl)-2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrole

Systemtic Name: 3-(2-ethoxyethyl)-2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrole Openeye Name: 3-(2-ethoxyethyl)-2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrole CAS Name: 3-(2-ethoxyethyl)-2-methyl-5-(4-methylsulfonylphenyl)-1-phenylpyrrole IUPAC Name: 3-(2-ethoxyethyl)-2-methyl-5-(4-methylsulfonylphenyl)-1-phenylpyrrole Traditional Name: 3-(2-ethoxyethyl)-5-(4-mesylphenyl)-2-methyl-1-phenyl-pyrrole Formula: C22H25NO3S MolecularWeight: 383.5038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCC1=C(N(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)C

Isomeric SMILES

CCOCCC1=C(N(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25NO3S/c1-4-26-15-14-19-16-22(18-10-12-21(13-11-18)27(3,24)25)23(17(19)2)20-8-6-5-7-9-20/h5-13,16H,4,14-15H2,1-3H3