1,3-benzodioxol-5-yl-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]methanone Formula: C18H16BrClN2O5S MolecularWeight: 487.75204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C18H16BrClN2O5S/c19-13-2-4-17(14(20)10-13)28(24,25)22-7-5-21(6-8-22)18(23)12-1-3-15-16(9-12)27-11-26-15/h1-4,9-10H,5-8,11H2