phenyl 2-[[(2-hydroxyphenyl)carbonylamino]-phenyl-methyl]-1-oxidanylidene-pentane-1-sulfonate

Systemtic Name: phenyl 2-[[(2-hydroxyphenyl)carbonylamino]-phenyl-methyl]-1-oxidanylidene-pentane-1-sulfonate Openeye Name: phenyl 2-[[(2-hydroxybenzoyl)amino]-phenyl-methyl]-1-oxo-pentane-1-sulfonate CAS Name: 2-[[[(2-hydroxyphenyl)-oxomethyl]amino]-phenylmethyl]-1-oxo-1-pentanesulfonic acid IUPAC Name: phenyl 2-[[(2-hydroxybenzoyl)amino]-phenylmethyl]-1-oxopentane-1-sulfonate Traditional Name: 1-keto-2-[phenyl-(salicyloylamino)methyl]pentane-1-sulfonic acid phenyl ester Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCCC(C(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H25NO6S/c1-2-11-21(25(29)33(30,31)32-19-14-7-4-8-15-19)23(18-12-5-3-6-13-18)26-24(28)20-16-9-10-17-22(20)27/h3-10,12-17,21,23,27H,2,11H2,1H3,(H,26,28)