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4-(hexadecanoylamino)naphthalene-1-sulfonic acid

4-(hexadecanoylamino)naphthalene-1-sulfonic acid

Systemtic Name:4-(hexadecanoylamino)naphthalene-1-sulfonic acid
Openeye Name:4-(hexadecanoylamino)naphthalene-1-sulfonic acid
CAS Name:4-(1-oxohexadecylamino)-1-naphthalenesulfonic acid
IUPAC Name:4-(hexadecanoylamino)naphthalene-1-sulfonic acid
Traditional Name:4-palmitamidonaphthalene-1-sulfonic acid
Formula: C26H39NO4S
MolecularWeight: 461.65716
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC=C(C2=CC=CC=C21)S(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC=C(C2=CC=CC=C21)S(=O)(=O)O


InChI

InChI=1S/C26H39NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-26(28)27-24-20-21-25(32(29,30)31)23-18-16-15-17-22(23)24/h15-18,20-21H,2-14,19H2,1H3,(H,27,28)(H,29,30,31)


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