6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one CAS Name: 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one Traditional Name: 6-(4-piperonylpiperazino)sulfonyl-3H-1,3-benzoxazol-2-one Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC5=C(C=C4)NC(=O)O5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC5=C(C=C4)NC(=O)O5

InChI

InChI=1S/C19H19N3O6S/c23-19-20-15-3-2-14(10-17(15)28-19)29(24,25)22-7-5-21(6-8-22)11-13-1-4-16-18(9-13)27-12-26-16/h1-4,9-10H,5-8,11-12H2,(H,20,23)