3-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxo-propyl]-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-oxopropyl]-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxopropyl]-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-3-[3-keto-3-(4-piperonylpiperazino)propyl]-1,3-benzoxazole-6-sulfonamide Formula: C22H24N4O7S MolecularWeight: 488.51356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCN4C5=C(C=C(C=C5)S(=O)(=O)N)OC4=O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCN4C5=C(C=C(C=C5)S(=O)(=O)N)OC4=O

InChI

InChI=1S/C22H24N4O7S/c23-34(29,30)16-2-3-17-19(12-16)33-22(28)26(17)6-5-21(27)25-9-7-24(8-10-25)13-15-1-4-18-20(11-15)32-14-31-18/h1-4,11-12H,5-10,13-14H2,(H2,23,29,30)