7-(decanoylamino)-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-(decanoylamino)-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-(decanoylamino)-4-hydroxy-naphthalene-2-sulfonic acid CAS Name: 4-hydroxy-7-(1-oxodecylamino)-2-naphthalenesulfonic acid IUPAC Name: 7-(decanoylamino)-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 7-(caprylamino)-4-hydroxy-naphthalene-2-sulfonic acid Formula: C20H27NO5S MolecularWeight: 393.49708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O

InChI

InChI=1S/C20H27NO5S/c1-2-3-4-5-6-7-8-9-20(23)21-16-10-11-18-15(12-16)13-17(14-19(18)22)27(24,25)26/h10-14,22H,2-9H2,1H3,(H,21,23)(H,24,25,26)