[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 5,6,7,8-tetrahydronaphthalene-2-sulfonate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 5,6,7,8-tetrahydronaphthalene-2-sulfonate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] tetralin-6-sulfonate CAS Name: 5,6,7,8-tetrahydronaphthalene-2-sulfonic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 5,6,7,8-tetrahydronaphthalene-2-sulfonate Traditional Name: tetralin-6-sulfonic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)OC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)OC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C20H21NO4S/c22-20-6-3-13-21(20)17-8-10-18(11-9-17)25-26(23,24)19-12-7-15-4-1-2-5-16(15)14-19/h7-12,14H,1-6,13H2