3-(4-nitrophenyl)sulfinylazepan-2-one

Systemtic Name: 3-(4-nitrophenyl)sulfinylazepan-2-one Openeye Name: 3-(4-nitrophenyl)sulfinylazepan-2-one CAS Name: 3-(4-nitrophenyl)sulfinyl-2-azepanone IUPAC Name: 3-(4-nitrophenyl)sulfinylazepan-2-one Traditional Name: 3-(4-nitrophenyl)sulfinylazepan-2-one Formula: C12H14N2O4S MolecularWeight: 282.31556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)S(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCNC(=O)C(C1)S(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O4S/c15-12-11(3-1-2-8-13-12)19(18)10-6-4-9(5-7-10)14(16)17/h4-7,11H,1-3,8H2,(H,13,15)