6-[(4-bromanylnaphthalen-1-yl)sulfonylamino]hexanoic acid

Systemtic Name: 6-[(4-bromanylnaphthalen-1-yl)sulfonylamino]hexanoic acid Openeye Name: 6-[(4-bromo-1-naphthyl)sulfonylamino]hexanoic acid CAS Name: 6-[(4-bromo-1-naphthalenyl)sulfonylamino]hexanoic acid IUPAC Name: 6-[(4-bromonaphthalen-1-yl)sulfonylamino]hexanoic acid Traditional Name: 6-[(4-bromo-1-naphthyl)sulfonylamino]hexanoic acid Formula: C16H18BrNO4S MolecularWeight: 400.28742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)NCCCCCC(=O)O

InChI

InChI=1S/C16H18BrNO4S/c17-14-9-10-15(13-7-4-3-6-12(13)14)23(21,22)18-11-5-1-2-8-16(19)20/h3-4,6-7,9-10,18H,1-2,5,8,11H2,(H,19,20)