2-[2-[(E)-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinylidene]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(E)-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinylidene]methyl]phenoxy]ethanoic acid Openeye Name: 2-[2-[(E)-[(3-pyrrolidin-1-ylsulfonylbenzoyl)hydrazono]methyl]phenoxy]acetic acid CAS Name: 2-[2-[(E)-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]hydrazinylidene]methyl]phenoxy]acetic acid IUPAC Name: 2-[2-[(E)-[(3-pyrrolidin-1-ylsulfonylbenzoyl)hydrazinylidene]methyl]phenoxy]acetic acid Traditional Name: 2-[2-[(E)-[(3-pyrrolidinosulfonylbenzoyl)hydrazono]methyl]phenoxy]acetic acid Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=CC3=CC=CC=C3OCC(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C/C3=CC=CC=C3OCC(=O)O

InChI

InChI=1S/C20H21N3O6S/c24-19(25)14-29-18-9-2-1-6-16(18)13-21-22-20(26)15-7-5-8-17(12-15)30(27,28)23-10-3-4-11-23/h1-2,5-9,12-13H,3-4,10-11,14H2,(H,22,26)(H,24,25)/b21-13+