[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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