1-[4-(3-ethylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[4-(3-ethylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-(3-ethylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[4-(3-ethylphenoxy)-3-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[4-(3-ethylphenoxy)-3-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[4-(3-ethylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine Formula: C18H20N2O5S MolecularWeight: 376.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5S/c1-2-14-6-5-7-15(12-14)25-18-9-8-16(13-17(18)20(21)22)26(23,24)19-10-3-4-11-19/h5-9,12-13H,2-4,10-11H2,1H3