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4-(hexadecanoylamino)naphthalene-1,5-disulfonic acid

4-(hexadecanoylamino)naphthalene-1,5-disulfonic acid

Systemtic Name:4-(hexadecanoylamino)naphthalene-1,5-disulfonic acid
Openeye Name:4-(hexadecanoylamino)naphthalene-1,5-disulfonic acid
CAS Name:4-(1-oxohexadecylamino)naphthalene-1,5-disulfonic acid
IUPAC Name:4-(hexadecanoylamino)naphthalene-1,5-disulfonic acid
Traditional Name:4-palmitamidonaphthalene-1,5-disulfonic acid
Formula: C26H39NO7S2
MolecularWeight: 541.72036
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=C2S(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=C2S(=O)(=O)O


InChI

InChI=1S/C26H39NO7S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25(28)27-22-19-20-23(35(29,30)31)21-16-15-17-24(26(21)22)36(32,33)34/h15-17,19-20H,2-14,18H2,1H3,(H,27,28)(H,29,30,31)(H,32,33,34)


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