[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(7-chloro-1,3-benzodioxol-5-yl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone Traditional Name: (4-brosylpiperazino)-(7-chloro-1,3-benzodioxol-5-yl)methanone Formula: C18H16BrClN2O5S MolecularWeight: 487.75204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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