[3-(hexadecanoylamino)-4-oxidanyl-naphthalen-2-yl] benzenesulfonate

Systemtic Name: [3-(hexadecanoylamino)-4-oxidanyl-naphthalen-2-yl] benzenesulfonate Openeye Name: [3-(hexadecanoylamino)-4-hydroxy-2-naphthyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-hydroxy-3-(1-oxohexadecylamino)-2-naphthalenyl] ester IUPAC Name: [3-(hexadecanoylamino)-4-hydroxynaphthalen-2-yl] benzenesulfonate Traditional Name: benzenesulfonic acid (4-hydroxy-3-palmitamido-2-naphthyl) ester Formula: C32H43NO5S MolecularWeight: 553.75252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=C(C2=CC=CC=C2C=C1OS(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=C(C2=CC=CC=C2C=C1OS(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C32H43NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-24-30(34)33-31-29(25-26-20-18-19-23-28(26)32(31)35)38-39(36,37)27-21-15-14-16-22-27/h14-16,18-23,25,35H,2-13,17,24H2,1H3,(H,33,34)