2-(1,3-dithian-2-yl)-3-nitro-benzoic acid

Systemtic Name: 2-(1,3-dithian-2-yl)-3-nitro-benzoic acid Openeye Name: 2-(1,3-dithian-2-yl)-3-nitro-benzoic acid CAS Name: 2-(1,3-dithian-2-yl)-3-nitrobenzoic acid IUPAC Name: 2-(1,3-dithian-2-yl)-3-nitrobenzoic acid Traditional Name: 2-(1,3-dithian-2-yl)-3-nitro-benzoic acid Formula: C11H11NO4S2 MolecularWeight: 285.33934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=C(C=CC=C2[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CSC(SC1)C2=C(C=CC=C2[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H11NO4S2/c13-10(14)7-3-1-4-8(12(15)16)9(7)11-17-5-2-6-18-11/h1,3-4,11H,2,5-6H2,(H,13,14)