N'-[3-(1,3-benzodioxol-5-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[3-(1,3-benzodioxol-5-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-[3-(1,3-benzodioxol-5-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide CAS Name: N'-[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]-3-(1-pyrrolidinylsulfonyl)benzohydrazide IUPAC Name: N'-[3-(1,3-benzodioxol-5-yl)propanoyl]-3-pyrrolidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-[3-(1,3-benzodioxol-5-yl)propanoyl]-3-pyrrolidinosulfonyl-benzohydrazide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23N3O6S/c25-20(9-7-15-6-8-18-19(12-15)30-14-29-18)22-23-21(26)16-4-3-5-17(13-16)31(27,28)24-10-1-2-11-24/h3-6,8,12-13H,1-2,7,9-11,14H2,(H,22,25)(H,23,26)