2-[4-[(Z)-C-phenyl-N-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-C-phenyl-N-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-C-phenyl-N-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[4-[(Z)-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]hydrazinylidene]-phenylmethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-C-phenyl-N-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]carbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[4-[(Z)-C-phenyl-N-[(3-pyrrolidinosulfonylbenzoyl)amino]carbonimidoyl]phenoxy]acetic acid Formula: C26H25N3O6S MolecularWeight: 507.5582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=C(C3=CC=CC=C3)C4=CC=C(C=C4)OCC(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C(/C3=CC=CC=C3)\C4=CC=C(C=C4)OCC(=O)O

InChI

InChI=1S/C26H25N3O6S/c30-24(31)18-35-22-13-11-20(12-14-22)25(19-7-2-1-3-8-19)27-28-26(32)21-9-6-10-23(17-21)36(33,34)29-15-4-5-16-29/h1-3,6-14,17H,4-5,15-16,18H2,(H,28,32)(H,30,31)/b27-25-