4-(azocan-1-ylsulfonyl)benzoic acid

Systemtic Name: 4-(azocan-1-ylsulfonyl)benzoic acid Openeye Name: 4-(azocan-1-ylsulfonyl)benzoic acid CAS Name: 4-(1-azocanylsulfonyl)benzoic acid IUPAC Name: 4-(azocan-1-ylsulfonyl)benzoic acid Traditional Name: 4-(azocan-1-ylsulfonyl)benzoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H19NO4S/c16-14(17)12-6-8-13(9-7-12)20(18,19)15-10-4-2-1-3-5-11-15/h6-9H,1-5,10-11H2,(H,16,17)