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4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzenecarbonitrile

4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzenecarbonitrile

Systemtic Name:4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzenecarbonitrile
Openeye Name:4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzonitrile
CAS Name:4-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-3-nitrobenzonitrile
IUPAC Name:4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-nitrobenzonitrile
Traditional Name:4-[4-(3-bromophenyl)sulfonylpiperazino]-3-nitro-benzonitrile
Formula: C17H15BrN4O4S
MolecularWeight: 451.2944
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)C3=CC(=CC=C3)Br


Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)C3=CC(=CC=C3)Br


InChI

InChI=1S/C17H15BrN4O4S/c18-14-2-1-3-15(11-14)27(25,26)21-8-6-20(7-9-21)16-5-4-13(12-19)10-17(16)22(23)24/h1-5,10-11H,6-9H2


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