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7-(octadecanoylamino)naphthalene-1,3-disulfonic acid

7-(octadecanoylamino)naphthalene-1,3-disulfonic acid

Systemtic Name:7-(octadecanoylamino)naphthalene-1,3-disulfonic acid
Openeye Name:7-(octadecanoylamino)naphthalene-1,3-disulfonic acid
CAS Name:7-(1-oxooctadecylamino)naphthalene-1,3-disulfonic acid
IUPAC Name:7-(octadecanoylamino)naphthalene-1,3-disulfonic acid
Traditional Name:7-stearamidonaphthalene-1,3-disulfonic acid
Formula: C28H43NO7S2
MolecularWeight: 569.77352
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)S(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)S(=O)(=O)O


InChI

InChI=1S/C28H43NO7S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(30)29-24-19-18-23-20-25(37(31,32)33)22-27(26(23)21-24)38(34,35)36/h18-22H,2-17H2,1H3,(H,29,30)(H,31,32,33)(H,34,35,36)


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